smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000297459651 132016081 /nfs/dbraw/zinc/01/60/81/132016081.db2.gz XRUCKNBQRVXUAU-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN CC[C@@H](N[C@@H](C)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000119648631 132135242 /nfs/dbraw/zinc/13/52/42/132135242.db2.gz CAFZSWVLEJLNOE-SCLBCKFNSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCc2cc(F)ccc21 ZINC000163503896 332807373 /nfs/dbraw/zinc/80/73/73/332807373.db2.gz RTOVSCPIHMZEHH-XIKOKIGWSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1ccc(CN[C@@H](c2cccs2)C2CC2)cc1[N+](=O)[O-] ZINC000518272554 332004165 /nfs/dbraw/zinc/00/41/65/332004165.db2.gz KIMJFZSFRWVWJP-MRXNPFEDSA-N 0 3 302.399 4.206 20 5 DIBDHN CC(C)C1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000559326785 332026040 /nfs/dbraw/zinc/02/60/40/332026040.db2.gz BOGSGDMUINEEHP-UHFFFAOYSA-N 0 3 300.358 4.133 20 5 DIBDHN CCN(Cc1cccc([N+](=O)[O-])c1)[C@H](C)c1ccc(F)cc1 ZINC000518474392 332061343 /nfs/dbraw/zinc/06/13/43/332061343.db2.gz LJAPKDVKRHWXME-CYBMUJFWSA-N 0 3 302.349 4.317 20 5 DIBDHN CC(F)(F)CCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449351627 332061443 /nfs/dbraw/zinc/06/14/43/332061443.db2.gz QOQQKXIOWPMTSI-UHFFFAOYSA-N 0 3 324.327 4.380 20 5 DIBDHN CCN(C/C=C/c1ccccc1[N+](=O)[O-])[C@H](C)c1cccnc1 ZINC000518507861 332070493 /nfs/dbraw/zinc/07/04/93/332070493.db2.gz LTHVZCLPAPGBCJ-JOZWUWCOSA-N 0 3 311.385 4.086 20 5 DIBDHN C[C@@H](NCCc1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000020526142 333319780 /nfs/dbraw/zinc/31/97/80/333319780.db2.gz BYJKDBQUUXCQNG-GFCCVEGCSA-N 0 3 304.777 4.142 20 5 DIBDHN C[C@H](NCCc1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000020526143 333319970 /nfs/dbraw/zinc/31/99/70/333319970.db2.gz BYJKDBQUUXCQNG-LBPRGKRZSA-N 0 3 304.777 4.142 20 5 DIBDHN C[C@H]1[C@@H](c2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000531202367 333330739 /nfs/dbraw/zinc/33/07/39/333330739.db2.gz ULQRNEXDGQSTCL-WFASDCNBSA-N 0 3 302.399 4.034 20 5 DIBDHN Cc1ccccc1OCCCN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000531959582 334315804 /nfs/dbraw/zinc/31/58/04/334315804.db2.gz MDWBFBZMTDJWCS-HNNXBMFYSA-N 0 3 314.385 4.023 20 5 DIBDHN Cc1ccccc1OCCCN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000531959583 334315986 /nfs/dbraw/zinc/31/59/86/334315986.db2.gz MDWBFBZMTDJWCS-OAHLLOKOSA-N 0 3 314.385 4.023 20 5 DIBDHN CC1(C)Cc2occc2[C@@H](NCCc2ccccc2[N+](=O)[O-])C1 ZINC000344089029 335216999 /nfs/dbraw/zinc/21/69/99/335216999.db2.gz LKBJYAHAZRWHDM-HNNXBMFYSA-N 0 3 314.385 4.034 20 5 DIBDHN CC[C@H](NCc1ccc([N+](=O)[O-])c(OC)c1)c1ccc(C)cc1 ZINC000352768917 336234027 /nfs/dbraw/zinc/23/40/27/336234027.db2.gz JWFDNRCBIXPSEN-INIZCTEOSA-N 0 3 314.385 4.153 20 5 DIBDHN CSc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000389431107 336390567 /nfs/dbraw/zinc/39/05/67/336390567.db2.gz ULGQXIIRXQPBSL-ZDUSSCGKSA-N 0 3 316.426 4.476 20 5 DIBDHN C[C@H]1CCCC[C@@H]1OCCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429262117 337156641 /nfs/dbraw/zinc/15/66/41/337156641.db2.gz DJXZQCAEOZAOBU-YOEHRIQHSA-N 0 3 320.433 4.015 20 5 DIBDHN CCC[C@H](NCc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120161934 337871020 /nfs/dbraw/zinc/87/10/20/337871020.db2.gz KYAGWXKKSSZRLY-KRWDZBQOSA-N 0 3 302.349 4.365 20 5 DIBDHN CCC[C@H](NCc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000120459483 337874329 /nfs/dbraw/zinc/87/43/29/337874329.db2.gz PHSDEWFQKNSTFM-KRWDZBQOSA-N 0 3 302.349 4.365 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN(C)Cc1cccc2[nH]ccc21 ZINC000426385031 338029859 /nfs/dbraw/zinc/02/98/59/338029859.db2.gz KDDBXBYJFGSSSY-UHFFFAOYSA-N 0 3 309.369 4.017 20 5 DIBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1cc2c(s1)CCCC2 ZINC000153357685 338223136 /nfs/dbraw/zinc/22/31/36/338223136.db2.gz UKGJMNCEXVIHTM-GFCCVEGCSA-N 0 3 316.426 4.386 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCSC(C)(C)CC1 ZINC000434682155 338223306 /nfs/dbraw/zinc/22/33/06/338223306.db2.gz VFNPNOOPDPVYKN-ZDUSSCGKSA-N 0 3 308.447 4.182 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCSC(C)(C)CC1 ZINC000434682154 338223373 /nfs/dbraw/zinc/22/33/73/338223373.db2.gz VFNPNOOPDPVYKN-CYBMUJFWSA-N 0 3 308.447 4.182 20 5 DIBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000434900333 338227256 /nfs/dbraw/zinc/22/72/56/338227256.db2.gz CWHJGZXJUHUNEX-HIFRSBDPSA-N 0 3 314.360 4.112 20 5 DIBDHN CC(C)(NC[C@H]1CCCCC1(F)F)c1ccccc1[N+](=O)[O-] ZINC000451055221 338719813 /nfs/dbraw/zinc/71/98/13/338719813.db2.gz NOOYNJXIKGJMCY-GFCCVEGCSA-N 0 3 312.360 4.245 20 5 DIBDHN Cc1cc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000451165152 338723944 /nfs/dbraw/zinc/72/39/44/338723944.db2.gz UJYPLKVHJKUJNN-QWHCGFSZSA-N 0 3 302.349 4.454 20 5 DIBDHN C[C@@H]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2)c2sccc21 ZINC000453138549 338798534 /nfs/dbraw/zinc/79/85/34/338798534.db2.gz AOQHHXCCZFQMCN-ABAIWWIYSA-N 0 3 302.399 4.385 20 5 DIBDHN C[C@H]1CCCc2ccccc2[C@@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000462542178 339081039 /nfs/dbraw/zinc/08/10/39/339081039.db2.gz LBSOTWQFHBFQMP-IFXJQAMLSA-N 0 3 310.397 4.398 20 5 DIBDHN CC(C)c1ccc(CN[C@@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000463710959 339124342 /nfs/dbraw/zinc/12/43/42/339124342.db2.gz PFZNMUGSVDVNOS-JTQLQIEISA-N 0 3 304.312 4.149 20 5 DIBDHN CC(C)c1ccc(CNCc2cccc3cc[nH]c32)cc1[N+](=O)[O-] ZINC000466903956 339220781 /nfs/dbraw/zinc/22/07/81/339220781.db2.gz BFFWSIZWPSLQPB-UHFFFAOYSA-N 0 3 323.396 4.489 20 5 DIBDHN Cc1cccc(OC[C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000467834917 339247196 /nfs/dbraw/zinc/24/71/96/339247196.db2.gz XBHFJJFLDOGJHG-CABCVRRESA-N 0 3 314.385 4.021 20 5 DIBDHN C[C@H](Cc1ccccc1F)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000467835111 339247213 /nfs/dbraw/zinc/24/72/13/339247213.db2.gz YMPDYERXTWGUMW-OLZOCXBDSA-N 0 3 302.349 4.016 20 5 DIBDHN Cc1ccc(OCCCN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000467846637 339247570 /nfs/dbraw/zinc/24/75/70/339247570.db2.gz PJZWORRFLGEKSK-OAHLLOKOSA-N 0 3 314.385 4.023 20 5 DIBDHN C[C@H](NCCc1ccc2ccccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000467846443 339247578 /nfs/dbraw/zinc/24/75/78/339247578.db2.gz NKCZBHALXAHRHN-AWEZNQCLSA-N 0 3 321.380 4.036 20 5 DIBDHN Cc1ccc(O[C@@H](C)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000467861605 339247948 /nfs/dbraw/zinc/24/79/48/339247948.db2.gz HTJFHTFIHGXCTC-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccccc1O[C@H](C)CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467863507 339248067 /nfs/dbraw/zinc/24/80/67/339248067.db2.gz NXWZEDDSFJFQJG-CABCVRRESA-N 0 3 314.385 4.021 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNC/C=C/c1ccccc1 ZINC000468593728 339266989 /nfs/dbraw/zinc/26/69/89/339266989.db2.gz BNYKNTYAWAAETP-AAALYJMCSA-N 0 3 308.381 4.301 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1cc(F)cc(F)c1 ZINC000468643610 339267783 /nfs/dbraw/zinc/26/77/83/339267783.db2.gz QWWBYYQUYHSFFV-XGICHPGQSA-N 0 3 318.323 4.066 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccc(F)c(F)c1 ZINC000468642837 339267801 /nfs/dbraw/zinc/26/78/01/339267801.db2.gz UKCJUWXPZGNPLP-KPKJPENVSA-N 0 3 318.323 4.066 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@H](C)c1ccco1 ZINC000470170001 339312563 /nfs/dbraw/zinc/31/25/63/339312563.db2.gz NEDRBTVCFFBPKG-QLKUMGTLSA-N 0 3 300.358 4.284 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)CCc1cccs1 ZINC000470171164 339312639 /nfs/dbraw/zinc/31/26/39/339312639.db2.gz GGPXXBLCWLFPJA-SDNWHVSQSA-N 0 3 316.426 4.234 20 5 DIBDHN C[C@@H](NC[C@H](C)Sc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000483619885 339669689 /nfs/dbraw/zinc/66/96/89/339669689.db2.gz HFUAXVPQSLFUHO-UONOGXRCSA-N 0 3 316.426 4.426 20 5 DIBDHN Cc1ccc([C@H](C)NCCc2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000484481692 339687255 /nfs/dbraw/zinc/68/72/55/339687255.db2.gz WRUAINBRBQKRCV-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN CC(C)(NCc1cccc2[nH]ccc21)c1ccccc1[N+](=O)[O-] ZINC000492038476 339889709 /nfs/dbraw/zinc/88/97/09/339889709.db2.gz AQZTVUVCCUNNFW-UHFFFAOYSA-N 0 3 309.369 4.101 20 5 DIBDHN CCOc1cc(CN[C@@H](C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000492610958 339905159 /nfs/dbraw/zinc/90/51/59/339905159.db2.gz YIYPVOKGRBBWMZ-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1ccc([C@@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000495372914 339981942 /nfs/dbraw/zinc/98/19/42/339981942.db2.gz BZZRWPQAPRTBSI-LLVKDONJSA-N 0 3 308.765 4.043 20 5 DIBDHN CCCN(CCc1cccc(F)c1)Cc1ccccc1[N+](=O)[O-] ZINC000500164803 340051800 /nfs/dbraw/zinc/05/18/00/340051800.db2.gz RCNMUDRLKNTMDH-UHFFFAOYSA-N 0 3 316.376 4.189 20 5 DIBDHN CC[C@@H]1C[C@@]1(NCc1ccc([N+](=O)[O-])cc1)c1cccc(C)c1 ZINC000500505756 340061090 /nfs/dbraw/zinc/06/10/90/340061090.db2.gz ZHAXEAVAFCROCF-APWZRJJASA-N 0 3 310.397 4.318 20 5 DIBDHN Cc1cc([C@@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])oc1C ZINC000502419311 340102754 /nfs/dbraw/zinc/10/27/54/340102754.db2.gz VJYFUKFIBGIHFO-LLVKDONJSA-N 0 3 322.792 4.351 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN(Cc1cccs1)C1CC1 ZINC000506618178 340197891 /nfs/dbraw/zinc/19/78/91/340197891.db2.gz SJOPDZNEGMQHRB-ZZXKWVIFSA-N 0 3 314.410 4.334 20 5 DIBDHN C[C@@H](NC/C=C/c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000512101954 340348624 /nfs/dbraw/zinc/34/86/24/340348624.db2.gz WQECZTCQOLNFDN-AAOUONPWSA-N 0 3 318.323 4.237 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@@H]2CCC[C@H]2c2ccccc2)cs1 ZINC000513073968 340392288 /nfs/dbraw/zinc/39/22/88/340392288.db2.gz FNTTXKSKKFVQLY-LSDHHAIUSA-N 0 3 302.399 4.082 20 5 DIBDHN CCN(CC)[C@@H](CNc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000513194710 340396381 /nfs/dbraw/zinc/39/63/81/340396381.db2.gz RYMRYXXOBHRBKR-INIZCTEOSA-N 0 3 319.430 4.151 20 5 DIBDHN Cc1c([C@@H](C)NCc2ccc3ncccc3c2)cccc1[N+](=O)[O-] ZINC000195149262 340575142 /nfs/dbraw/zinc/57/51/42/340575142.db2.gz NKUIJEURRJYDFZ-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CC1(C)CC[C@@H](NCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000236747662 340664642 /nfs/dbraw/zinc/66/46/42/340664642.db2.gz JCCFNMWYXBOPCP-GOSISDBHSA-N 0 3 310.397 4.497 20 5 DIBDHN CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000539092114 340872747 /nfs/dbraw/zinc/87/27/47/340872747.db2.gz XAWAUZZSONQOKY-UGSOOPFHSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1cc([C@@H](C)NCCOc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000542529399 341012362 /nfs/dbraw/zinc/01/23/62/341012362.db2.gz BNHOWDGPOOLRHA-GFCCVEGCSA-N 0 3 320.414 4.003 20 5 DIBDHN C[C@@H](Cc1ccsc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000543058584 341029578 /nfs/dbraw/zinc/02/95/78/341029578.db2.gz VGWXJUKOMXFUPU-ZDUSSCGKSA-N 0 3 316.426 4.252 20 5 DIBDHN CC[C@H](NC[C@H](OC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000131486011 341091374 /nfs/dbraw/zinc/09/13/74/341091374.db2.gz SOPNCNWFDWPZEN-ROUUACIJSA-N 0 3 314.385 4.023 20 5 DIBDHN CC[C@@H](CC(F)(F)F)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000544833560 341095635 /nfs/dbraw/zinc/09/56/35/341095635.db2.gz WXVDKSMQDJQXFM-AAEUAGOBSA-N 0 3 304.312 4.367 20 5 DIBDHN CCC1(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC1 ZINC000236655848 341192486 /nfs/dbraw/zinc/19/24/86/341192486.db2.gz WRFBUJLGFJYOFH-UHFFFAOYSA-N 0 3 300.358 4.277 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H]1c1ccncc1 ZINC000564314070 341198249 /nfs/dbraw/zinc/19/82/49/341198249.db2.gz AYRZUAJKORMCCZ-LJQBUTKESA-N 0 3 323.396 4.230 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC000547726912 341229000 /nfs/dbraw/zinc/22/90/00/341229000.db2.gz YVPIEBRRHPIXBQ-NSHDSACASA-N 0 3 322.767 4.281 20 5 DIBDHN CC[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000547727108 341229062 /nfs/dbraw/zinc/22/90/62/341229062.db2.gz BVFNVRSAMZPAOV-INIZCTEOSA-N 0 3 320.339 4.156 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCCO[C@@H]1CC(C)C ZINC000547831495 341236142 /nfs/dbraw/zinc/23/61/42/341236142.db2.gz LEAAJBLJHPYPLP-JCGIZDLHSA-N 0 3 320.433 4.148 20 5 DIBDHN Cc1c(CN2CCC(C)=C(c3ccco3)C2)cccc1[N+](=O)[O-] ZINC000549159781 341287401 /nfs/dbraw/zinc/28/74/01/341287401.db2.gz SRHQCHGLKYPUEA-UHFFFAOYSA-N 0 3 312.369 4.176 20 5 DIBDHN Cc1ccc(CNCc2ccc(C(C)(F)F)cc2)cc1[N+](=O)[O-] ZINC000549829800 341304375 /nfs/dbraw/zinc/30/43/75/341304375.db2.gz ZLWNYDORIAFPMM-UHFFFAOYSA-N 0 3 320.339 4.305 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](c2cccc(F)c2)C1 ZINC000552515101 341397043 /nfs/dbraw/zinc/39/70/43/341397043.db2.gz YJKCHBZUIOBMEX-BBRMVZONSA-N 0 3 314.360 4.284 20 5 DIBDHN C[C@H](CN[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000552557519 341398617 /nfs/dbraw/zinc/39/86/17/341398617.db2.gz VBYOABMKWAYFQN-OLZOCXBDSA-N 0 3 302.349 4.188 20 5 DIBDHN C[C@H](NC1CC(C)(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000554194734 341446561 /nfs/dbraw/zinc/44/65/61/341446561.db2.gz OLNJCJMBWBZNAR-ASFAAARLSA-N 0 3 310.397 4.366 20 5 DIBDHN O=[N+]([O-])c1cc(CNC[C@H]2CCCC[C@H]2C(F)(F)F)cs1 ZINC000554719800 341461956 /nfs/dbraw/zinc/46/19/56/341461956.db2.gz LZUVSUNZIYQMGI-GHMZBOCLSA-N 0 3 322.352 4.115 20 5 DIBDHN COc1cccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000267470470 341591624 /nfs/dbraw/zinc/59/16/24/341591624.db2.gz XQDJCTVAWKVYED-QWHCGFSZSA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1nccc2ccccc21 ZINC000577564680 341918101 /nfs/dbraw/zinc/91/81/01/341918101.db2.gz RUIZUYUIYITGFV-AWEZNQCLSA-N 0 3 321.380 4.036 20 5 DIBDHN COc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)ccc1C ZINC000177986664 341940969 /nfs/dbraw/zinc/94/09/69/341940969.db2.gz YEDJMLXTEIFFFT-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN Cc1c([C@@H](C)NCc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000178043122 341942302 /nfs/dbraw/zinc/94/23/02/341942302.db2.gz TVZKCJHFGXDOID-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN Cc1ccc([C@@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)s1 ZINC000261485314 1036727651 /nfs/dbraw/zinc/72/76/51/1036727651.db2.gz QKKXRAKRILNIAY-HNNXBMFYSA-N 0 3 302.399 4.302 20 5 DIBDHN CCS[C@H]1CCCCN(Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC001167363973 1036985566 /nfs/dbraw/zinc/98/55/66/1036985566.db2.gz QIAUAKVZWGASOQ-HNNXBMFYSA-N 0 3 308.447 4.011 20 5 DIBDHN CCCc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000598640868 1038143417 /nfs/dbraw/zinc/14/34/17/1038143417.db2.gz OTSSISUNUXKXKB-LBPRGKRZSA-N 0 3 304.415 4.460 20 5 DIBDHN CC(C)C[C@H]1CCCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610710615 1038267559 /nfs/dbraw/zinc/26/75/59/1038267559.db2.gz ANGVVCLQEPHDBE-CYBMUJFWSA-N 0 3 317.389 4.137 20 5 DIBDHN COc1ccc(CN(Cc2ccccc2)C(C)C)cc1[N+](=O)[O-] ZINC000603845057 1038295762 /nfs/dbraw/zinc/29/57/62/1038295762.db2.gz BBNPLJCKUBGNLP-UHFFFAOYSA-N 0 3 314.385 4.014 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H]3CCC(F)(F)C3)o2)c1 ZINC000610787723 1038308368 /nfs/dbraw/zinc/30/83/68/1038308368.db2.gz GZMVBPKRNGGCMU-GFCCVEGCSA-N 0 3 322.311 4.132 20 5 DIBDHN CCCN(Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000603925865 1038324429 /nfs/dbraw/zinc/32/44/29/1038324429.db2.gz DBDFWJCZXONZRO-UHFFFAOYSA-N 0 3 314.385 4.016 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H]2c3ccccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000540177984 1038607158 /nfs/dbraw/zinc/60/71/58/1038607158.db2.gz YLGOOIGBHGVPIL-BIENJYKASA-N 0 3 310.397 4.487 20 5 DIBDHN Cc1c(CN[C@H]2CCCc3sccc32)cccc1[N+](=O)[O-] ZINC000061362321 1039045927 /nfs/dbraw/zinc/04/59/27/1039045927.db2.gz SWXVFUAOPDQEKF-AWEZNQCLSA-N 0 3 302.399 4.132 20 5 DIBDHN COc1cc(CN[C@@H](C)c2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000492855664 1040031836 /nfs/dbraw/zinc/03/18/36/1040031836.db2.gz ZDJXMEYWICPOTA-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN CCOc1cccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000180708038 1041198131 /nfs/dbraw/zinc/19/81/31/1041198131.db2.gz RAAUWBGYLWEWFV-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN CCN(C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](C)c1cccnc1 ZINC000290440267 1041506119 /nfs/dbraw/zinc/50/61/19/1041506119.db2.gz LTHVZCLPAPGBCJ-XMELGKRDSA-N 0 3 311.385 4.086 20 5 DIBDHN CC1(C)CC[C@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811506299 1041533786 /nfs/dbraw/zinc/53/37/86/1041533786.db2.gz PJZKQUVGVMURSD-LLVKDONJSA-N 0 3 303.189 4.180 20 5 DIBDHN C[C@@H](CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433239097 1042461851 /nfs/dbraw/zinc/46/18/51/1042461851.db2.gz JAFOLIIEFPWXFP-ZANVPECISA-N 0 3 316.323 4.105 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000067248273 1042489500 /nfs/dbraw/zinc/48/95/00/1042489500.db2.gz VWCRKJODHINXKA-SNVBAGLBSA-N 0 3 310.806 4.469 20 5 DIBDHN COc1ccc(CN(C)[C@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000515777018 1042835188 /nfs/dbraw/zinc/83/51/88/1042835188.db2.gz VTXHYPWKCSNQFQ-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000120785712 1042951932 /nfs/dbraw/zinc/95/19/32/1042951932.db2.gz LXCFBXAYNHMTKL-QWHCGFSZSA-N 0 3 302.349 4.454 20 5 DIBDHN Cc1ccc([C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)s1 ZINC000261485315 1043089914 /nfs/dbraw/zinc/08/99/14/1043089914.db2.gz QKKXRAKRILNIAY-OAHLLOKOSA-N 0 3 302.399 4.302 20 5 DIBDHN C[C@@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000866606834 1043233381 /nfs/dbraw/zinc/23/33/81/1043233381.db2.gz IRPYZOJRUJRSQL-LERXQTSPSA-N 0 3 314.307 4.143 20 5 DIBDHN C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)COC2 ZINC000268811582 1043333507 /nfs/dbraw/zinc/33/35/07/1043333507.db2.gz OCQZHPBTRHTCLK-CHWSQXEVSA-N 0 3 312.369 4.037 20 5 DIBDHN CC1=C(c2ccco2)CN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000558734621 1043581842 /nfs/dbraw/zinc/58/18/42/1043581842.db2.gz QTMTWYUWSHVTON-CQSZACIVSA-N 0 3 312.369 4.428 20 5 DIBDHN CC[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1cccc(C)c1 ZINC000353385970 1043603712 /nfs/dbraw/zinc/60/37/12/1043603712.db2.gz LCVXDYBXJQRXSR-INIZCTEOSA-N 0 3 314.385 4.153 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000926904446 1043652721 /nfs/dbraw/zinc/65/27/21/1043652721.db2.gz XRUCKNBQRVXUAU-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN CCOc1cccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000126104686 1043704949 /nfs/dbraw/zinc/70/49/49/1043704949.db2.gz WWXVOPDBOROISE-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CCCc2ccc(F)cc21 ZINC000355531787 1043773689 /nfs/dbraw/zinc/77/36/89/1043773689.db2.gz KWIRTXCKWKYJJJ-SFHVURJKSA-N 0 3 314.360 4.210 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000933486813 1044198270 /nfs/dbraw/zinc/19/82/70/1044198270.db2.gz XRUCKNBQRVXUAU-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@@H](NCC(C)(C)CC(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000883260214 1044250629 /nfs/dbraw/zinc/25/06/29/1044250629.db2.gz NSHCEIVRDJVDLQ-SECBINFHSA-N 0 3 304.312 4.066 20 5 DIBDHN Cc1ccc2c(c1)CC[C@H]2NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597539 1044505499 /nfs/dbraw/zinc/50/54/99/1044505499.db2.gz NLJDREUBWQVPTM-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN C[C@H](N[C@H]1CCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000296782963 1044646393 /nfs/dbraw/zinc/64/63/93/1044646393.db2.gz SENDKZZSYFVSPE-GTNSWQLSSA-N 0 3 300.333 4.072 20 5 DIBDHN CC[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000037507780 1044713353 /nfs/dbraw/zinc/71/33/53/1044713353.db2.gz VVQOQIFLRPMGJU-MRXNPFEDSA-N 0 3 304.777 4.489 20 5 DIBDHN CCOc1cc(CN[C@H](CC)c2ccccc2)ccc1[N+](=O)[O-] ZINC000411895268 1045035268 /nfs/dbraw/zinc/03/52/68/1045035268.db2.gz SQGGJSFKRIXDGY-MRXNPFEDSA-N 0 3 314.385 4.234 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1cccc(Cl)c1)CCC2 ZINC000447511393 1045137410 /nfs/dbraw/zinc/13/74/10/1045137410.db2.gz TYQMEVYHPRZFCS-KRWDZBQOSA-N 0 3 316.788 4.415 20 5 DIBDHN Cc1cc2cc(CN[C@@H]3CCc4c3cccc4[N+](=O)[O-])ccc2[nH]1 ZINC000578642920 1045260326 /nfs/dbraw/zinc/26/03/26/1045260326.db2.gz GUZKKVACCRTPJR-GOSISDBHSA-N 0 3 321.380 4.162 20 5 DIBDHN C[C@H]1[C@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801522051 1045730831 /nfs/dbraw/zinc/73/08/31/1045730831.db2.gz XZRDHSVIBFGBQR-XJKSGUPXSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2c(F)cccc21)c1cccc([N+](=O)[O-])c1 ZINC000453232002 1045997559 /nfs/dbraw/zinc/99/75/59/1045997559.db2.gz IYBNGLBWXWPXRP-KPZWWZAWSA-N 0 3 314.360 4.462 20 5 DIBDHN C[C@@H](NCC1C[C@H]2CC[C@@H](C1)S2)c1c(F)cccc1[N+](=O)[O-] ZINC000903157149 1046179084 /nfs/dbraw/zinc/17/90/84/1046179084.db2.gz ZBBBOSRZBQHCEP-ODWCKFRGSA-N 0 3 324.421 4.059 20 5 DIBDHN C[C@H](N[C@@H]1CCSC(C)(C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000903280032 1046220882 /nfs/dbraw/zinc/22/08/82/1046220882.db2.gz AHCHTQHKMIYKBZ-WDEREUQCSA-N 0 3 312.410 4.059 20 5 DIBDHN CC[C@@H](N[C@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903426914 1046274846 /nfs/dbraw/zinc/27/48/46/1046274846.db2.gz CMOJPGHQPHQZLN-MSOLQXFVSA-N 0 3 311.385 4.182 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H](c2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000903427631 1046277389 /nfs/dbraw/zinc/27/73/89/1046277389.db2.gz IAVIBHDZAOEWHC-ACJLOTCBSA-N 0 3 311.385 4.100 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H](c1ccncc1)C1CC1)CCC2 ZINC000903427809 1046278152 /nfs/dbraw/zinc/27/81/52/1046278152.db2.gz KFHHBCASQSMKEM-RBUKOAKNSA-N 0 3 323.396 4.108 20 5 DIBDHN CN(Cc1cccnn1)Cc1c2ccccc2cc2ccccc21 ZINC001139972496 1046560287 /nfs/dbraw/zinc/56/02/87/1046560287.db2.gz SETHYPOJACIHLU-UHFFFAOYSA-N 0 3 313.404 4.415 20 5 DIBDHN CN(Cc1ccnnc1)Cc1c2ccccc2cc2ccccc21 ZINC001139983408 1046563480 /nfs/dbraw/zinc/56/34/80/1046563480.db2.gz CYJWKTXSOWBYJP-UHFFFAOYSA-N 0 3 313.404 4.415 20 5 DIBDHN C[C@H](C1CC1)N(Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000302836510 1046807559 /nfs/dbraw/zinc/80/75/59/1046807559.db2.gz GXJPEXJPPRQILM-OAHLLOKOSA-N 0 3 310.397 4.396 20 5 DIBDHN CCOc1ccc([C@@H](C)NCc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000152573197 1047254278 /nfs/dbraw/zinc/25/42/78/1047254278.db2.gz XBNPORACPWJDIJ-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN O=C1CCN(Cc2c3ccccc3cc3ccccc32)CC[C@H]1F ZINC001141723416 1047277988 /nfs/dbraw/zinc/27/79/88/1047277988.db2.gz WUFRFPHETBGDAB-HXUWFJFHSA-N 0 3 321.395 4.496 20 5 DIBDHN CC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000192785914 1047628114 /nfs/dbraw/zinc/62/81/14/1047628114.db2.gz VMFDXCAFCVHBJH-SCLBCKFNSA-N 0 3 314.385 4.405 20 5 DIBDHN CCc1cnccc1[C@@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000538113254 1047658382 /nfs/dbraw/zinc/65/83/82/1047658382.db2.gz BRYGBKFWLFEDOQ-KGLIPLIRSA-N 0 3 313.401 4.272 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@@H]1CSc2ccccc21 ZINC000538400311 1047672285 /nfs/dbraw/zinc/67/22/85/1047672285.db2.gz OINGZALERZKWRZ-ZQMJAJRESA-N 0 3 312.394 4.045 20 5 DIBDHN C[C@H](N[C@H]1C[C@H](OC(C)(C)C)C1(C)C)c1ccccc1[N+](=O)[O-] ZINC001183651449 1047951373 /nfs/dbraw/zinc/95/13/73/1047951373.db2.gz DTXMYANKQWHEQO-RCBQFDQVSA-N 0 3 320.433 4.228 20 5 DIBDHN Cc1c(CNCc2cc3ccccc3s2)cccc1[N+](=O)[O-] ZINC000480485759 1048151114 /nfs/dbraw/zinc/15/11/14/1048151114.db2.gz FGPDQTBKNBBLJF-UHFFFAOYSA-N 0 3 312.394 4.408 20 5 DIBDHN C[C@@H]1CC(C)(C)CC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000481086852 1048307264 /nfs/dbraw/zinc/30/72/64/1048307264.db2.gz CWLFOZCTYVZWHX-YPMHNXCESA-N 0 3 317.389 4.040 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN1CC[C@]1(C)C1CCCCC1 ZINC001175643701 1048388728 /nfs/dbraw/zinc/38/87/28/1048388728.db2.gz ZFZGFOIHHYSCNO-GOSISDBHSA-N 0 3 318.417 4.148 20 5 DIBDHN Cc1c(CNCc2ccc(C3CCC3)cc2)cccc1[N+](=O)[O-] ZINC000555583747 1048396714 /nfs/dbraw/zinc/39/67/14/1048396714.db2.gz YASGQMJUJFFFGL-UHFFFAOYSA-N 0 3 310.397 4.461 20 5 DIBDHN C[C@@H](NC/C=C/c1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001179575887 1049179667 /nfs/dbraw/zinc/17/96/67/1049179667.db2.gz YJTIKGZNDIFKNP-QAVQXKDTSA-N 0 3 318.323 4.237 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCS[C@H](C(C)C)C1 ZINC001204681214 1049222837 /nfs/dbraw/zinc/22/28/37/1049222837.db2.gz ITYWLQUBJOKAGV-DZXKJOIRSA-N 0 3 320.458 4.072 20 5 DIBDHN CC[C@@H](C)CN(CC)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001179980509 1049242777 /nfs/dbraw/zinc/24/27/77/1049242777.db2.gz QXYDNLCRLQENKM-LLVKDONJSA-N 0 3 318.339 4.482 20 5 DIBDHN C[C@H](N(C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C ZINC001180253203 1049321069 /nfs/dbraw/zinc/32/10/69/1049321069.db2.gz HRQVQAHGOKZYGD-JTQLQIEISA-N 0 3 318.339 4.480 20 5 DIBDHN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCC[C@@H](C)C1 ZINC001195179671 1049483986 /nfs/dbraw/zinc/48/39/86/1049483986.db2.gz OHCPSMLATJZGAX-AGIUHOORSA-N 0 3 317.389 4.040 20 5 DIBDHN CC1(C)CCC[C@H]1[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195429019 1049533552 /nfs/dbraw/zinc/53/35/52/1049533552.db2.gz ZDAJUEJCEWKXAD-CJNGLKHVSA-N 0 3 320.408 4.382 20 5 DIBDHN O=[N+]([O-])c1ccc(F)cc1CN1CC[C@@H](C2CCCCC2)C1 ZINC001195885476 1049585541 /nfs/dbraw/zinc/58/55/41/1049585541.db2.gz XSGIPQGZSXVPDY-CQSZACIVSA-N 0 3 306.381 4.136 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN1CCCC2(CCCC2)CC1 ZINC001196040400 1049609225 /nfs/dbraw/zinc/60/92/25/1049609225.db2.gz VWVVBVLWGKRDKB-UHFFFAOYSA-N 0 3 306.381 4.280 20 5 DIBDHN CC[C@@H]1CCCC[C@@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001206055733 1049642537 /nfs/dbraw/zinc/64/25/37/1049642537.db2.gz MBSRRLLURPRULW-CHWSQXEVSA-N 0 3 317.389 4.042 20 5 DIBDHN CC(C)(NCc1ccc(Cl)c([N+](=O)[O-])c1)c1cccs1 ZINC000735086792 1050344679 /nfs/dbraw/zinc/34/46/79/1050344679.db2.gz SGQHMQGZVCVMNC-UHFFFAOYSA-N 0 3 310.806 4.335 20 5 DIBDHN C[C@H](F)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000574394330 1050457047 /nfs/dbraw/zinc/45/70/47/1050457047.db2.gz SIDSSZSETMCBPO-SUMWQHHRSA-N 0 3 302.349 4.022 20 5 DIBDHN C[C@@H](F)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000574394327 1050457754 /nfs/dbraw/zinc/45/77/54/1050457754.db2.gz SIDSSZSETMCBPO-CXAGYDPISA-N 0 3 302.349 4.022 20 5 DIBDHN CC[C@H](NCc1cc(COC)cs1)c1cccc([N+](=O)[O-])c1 ZINC000594935706 1050575666 /nfs/dbraw/zinc/57/56/66/1050575666.db2.gz GZSWOIDEMFIKKF-INIZCTEOSA-N 0 3 320.414 4.044 20 5 DIBDHN Cc1ccc2cc(CNC(C)(C)c3ccc([N+](=O)[O-])cc3)[nH]c2c1 ZINC000594942638 1050578401 /nfs/dbraw/zinc/57/84/01/1050578401.db2.gz XYBFRSCHWHFWQJ-UHFFFAOYSA-N 0 3 323.396 4.409 20 5 DIBDHN CC[C@@H](NCc1cccc(OC)c1C)c1cccc([N+](=O)[O-])c1 ZINC000595102245 1050608360 /nfs/dbraw/zinc/60/83/60/1050608360.db2.gz DIFJIQMNOKVYLM-QGZVFWFLSA-N 0 3 314.385 4.153 20 5 DIBDHN CSc1cccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000595422382 1050632509 /nfs/dbraw/zinc/63/25/09/1050632509.db2.gz WZLJIBLCXGBMNL-ZDUSSCGKSA-N 0 3 316.426 4.476 20 5 DIBDHN 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314.360 4.462 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)CN(CCC1CCCCCC1)CC2 ZINC001615846198 1056584842 /nfs/dbraw/zinc/58/48/42/1056584842.db2.gz GYDBWMJXEHFVTQ-UHFFFAOYSA-N 0 3 302.418 4.313 20 5 DIBDHN c1ccc2cc3cc(-c4ncnc5c4CCNC5)ccc3cc2c1 ZINC001240679677 1056637135 /nfs/dbraw/zinc/63/71/35/1056637135.db2.gz HLLQKBKMJABEHG-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN CCC1(CC)CN(Cc2ccc(C)c([N+](=O)[O-])c2)CCS1 ZINC001617024025 1056760936 /nfs/dbraw/zinc/76/09/36/1056760936.db2.gz QDTBTPFYXFUCTC-UHFFFAOYSA-N 0 3 308.447 4.011 20 5 DIBDHN Cc1cc(NCCCC(F)(F)F)c2cc([N+](=O)[O-])ccc2n1 ZINC000317151778 1056996600 /nfs/dbraw/zinc/99/66/00/1056996600.db2.gz RMFUYTKFWFQDOP-UHFFFAOYSA-N 0 3 313.279 4.206 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2-c1cc2c(nn1)CCNC2 ZINC001241378868 1057031487 /nfs/dbraw/zinc/03/14/87/1057031487.db2.gz MHUFYAXPJLJHAO-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H]1c1ccc(O)cc1 ZINC000611265461 1057587562 /nfs/dbraw/zinc/58/75/62/1057587562.db2.gz 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CC[C@H](C)[C@@H]1CCCCN1Cc1cc([N+](=O)[O-])ccc1OC ZINC001473178525 1063486667 /nfs/dbraw/zinc/48/66/67/1063486667.db2.gz HQFFQNODCFESGM-BBRMVZONSA-N 0 3 306.406 4.004 20 5 DIBDHN CC(C)c1ccc(CCN(C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC001461892251 1063780240 /nfs/dbraw/zinc/78/02/40/1063780240.db2.gz OBDLHPKEMZKHIH-UHFFFAOYSA-N 0 3 312.413 4.393 20 5 DIBDHN C[C@H](N[C@@H]1CS[C@@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000488442123 1063906417 /nfs/dbraw/zinc/90/64/17/1063906417.db2.gz MKKVRROJAXHFKK-SLEUVZQESA-N 0 3 308.447 4.166 20 5 DIBDHN Cc1ccccc1[C@H]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001307443321 1065404711 /nfs/dbraw/zinc/40/47/11/1065404711.db2.gz BANNLDFLWOYMFM-AWEZNQCLSA-N 0 3 314.360 4.032 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN1CCCC2(CCCCC2)C1 ZINC001307459587 1065412628 /nfs/dbraw/zinc/41/26/28/1065412628.db2.gz WUHAPJMOKLSKFO-UHFFFAOYSA-N 0 3 318.417 4.150 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@H](C)CCC[C@H]1C ZINC001307478088 1065425412 /nfs/dbraw/zinc/42/54/12/1065425412.db2.gz ISEUSHLTDYFNAB-HUUCEWRRSA-N 0 3 320.433 4.393 20 5 DIBDHN C[C@@]1(CCc2ccccc2)CCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC001307518501 1065457384 /nfs/dbraw/zinc/45/73/84/1065457384.db2.gz RDKREKLHBHUAEK-HXUWFJFHSA-N 0 3 324.424 4.440 20 5 DIBDHN Cc1c(CNCc2ccccc2CC(C)C)cccc1[N+](=O)[O-] ZINC001308473710 1066013350 /nfs/dbraw/zinc/01/33/50/1066013350.db2.gz NXLVRERPEVVTTI-UHFFFAOYSA-N 0 3 312.413 4.392 20 5 DIBDHN CC(C)CN(Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC001308582546 1066098602 /nfs/dbraw/zinc/09/86/02/1066098602.db2.gz GBSAZOQQPZUOGS-UHFFFAOYSA-N 0 3 316.323 4.234 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC(C2CCCC2)C1 ZINC001308809600 1066286732 /nfs/dbraw/zinc/28/67/32/1066286732.db2.gz OBHPYBXJZBNIBX-ZROIWOOFSA-N 0 3 300.402 4.120 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(OC(C)(C)C)CC1 ZINC000272407564 130027004 /nfs/dbraw/zinc/02/70/04/130027004.db2.gz ZZLKSXIJZJHBMO-AWEZNQCLSA-N 0 3 320.433 4.244 20 5 DIBDHN CN(Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000288773454 131338415 /nfs/dbraw/zinc/33/84/15/131338415.db2.gz ILYRHTNNONIJLQ-BETUJISGSA-N 0 3 316.323 4.148 20 5 DIBDHN Cc1nc2c(s1)[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000297283836 132007671 /nfs/dbraw/zinc/00/76/71/132007671.db2.gz LKTJFFAOSPCNLZ-HZMBPMFUSA-N 0 3 317.414 4.088 20 5 DIBDHN COc1cccc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000119649271 132135177 /nfs/dbraw/zinc/13/51/77/132135177.db2.gz VBSIVVHMHXQFFI-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN CC[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000035055404 331467765 /nfs/dbraw/zinc/46/77/65/331467765.db2.gz YWWVYDZSILMDPB-MRXNPFEDSA-N 0 3 304.777 4.489 20 5 DIBDHN Cc1c([C@H](C)NCCc2cccc(F)c2F)cccc1[N+](=O)[O-] ZINC000557267939 331779245 /nfs/dbraw/zinc/77/92/45/331779245.db2.gz KGAMSQRRYTYWJT-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN Cc1c(CN(Cc2cccs2)C(C)C)cccc1[N+](=O)[O-] ZINC000518596370 332090494 /nfs/dbraw/zinc/09/04/94/332090494.db2.gz UYOZBGOHBXNAJV-UHFFFAOYSA-N 0 3 304.415 4.375 20 5 DIBDHN CCC[C@@H](NCC1(C(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000560583945 332365082 /nfs/dbraw/zinc/36/50/82/332365082.db2.gz DLIZHDDGTLRVNZ-CYBMUJFWSA-N 0 3 316.323 4.368 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CC(C4CCC4)C3)o2)cc1 ZINC000569888838 332689615 /nfs/dbraw/zinc/68/96/15/332689615.db2.gz LXXILITVHQQQBS-UHFFFAOYSA-N 0 3 312.369 4.087 20 5 DIBDHN C[C@@H]1CCCc2ccccc2[C@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000462542179 332979962 /nfs/dbraw/zinc/97/99/62/332979962.db2.gz LBSOTWQFHBFQMP-KUHUBIRLSA-N 0 3 310.397 4.398 20 5 DIBDHN Cc1ccccc1[C@@H](C)NCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000105810173 332992975 /nfs/dbraw/zinc/99/29/75/332992975.db2.gz DHSGEVBVBWVCHC-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN Cc1cc(NCCCCOC(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000181568699 333030875 /nfs/dbraw/zinc/03/08/75/333030875.db2.gz KTZQICOQXXDDBM-UHFFFAOYSA-N 0 3 317.389 4.069 20 5 DIBDHN O=[N+]([O-])c1cccc(CN[C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000111158719 333059565 /nfs/dbraw/zinc/05/95/65/333059565.db2.gz GSZNSOQLXLCAPO-MRXNPFEDSA-N 0 3 302.761 4.025 20 5 DIBDHN CC[C@@H]1C[C@@H](C)CN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000466934902 333101138 /nfs/dbraw/zinc/10/11/38/333101138.db2.gz GOLVJMSKOVSGDE-UKRRQHHQSA-N 0 3 306.406 4.002 20 5 DIBDHN CSc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000525880966 335127549 /nfs/dbraw/zinc/12/75/49/335127549.db2.gz KVBCZHMDMOTAGI-CYBMUJFWSA-N 0 3 316.426 4.476 20 5 DIBDHN O=[N+]([O-])c1ccc(CCNCc2ccc(-c3ccccc3)o2)cc1 ZINC000518777743 333161859 /nfs/dbraw/zinc/16/18/59/333161859.db2.gz SLVCAFHHMMZODV-UHFFFAOYSA-N 0 3 322.364 4.187 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]1c1ccccn1 ZINC000526063106 333384585 /nfs/dbraw/zinc/38/45/85/333384585.db2.gz WHGHYGDXZHBNPF-QZEGLACASA-N 0 3 323.396 4.230 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]1c1ccccn1 ZINC000526063107 333384628 /nfs/dbraw/zinc/38/46/28/333384628.db2.gz WHGHYGDXZHBNPF-RYBIEJRYSA-N 0 3 323.396 4.230 20 5 DIBDHN Cc1cc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)c(C)s1 ZINC000049507060 334342941 /nfs/dbraw/zinc/34/29/41/334342941.db2.gz ZKYOFYWBFJBQMY-LBPRGKRZSA-N 0 3 304.415 4.432 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H]1CCCc2sccc21 ZINC000341558882 334452140 /nfs/dbraw/zinc/45/21/40/334452140.db2.gz FKBRLMYLBUEVBS-DRDHIDPGSA-N 0 3 314.410 4.337 20 5 DIBDHN CCOc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000192543725 336073216 /nfs/dbraw/zinc/07/32/16/336073216.db2.gz HLJTVVZXXCVJIC-KGLIPLIRSA-N 0 3 314.385 4.405 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1CCCC(F)(F)C1)CCC2 ZINC000332252441 336165129 /nfs/dbraw/zinc/16/51/29/336165129.db2.gz YBMLBHQSWCQMOH-DOMZBBRYSA-N 0 3 310.344 4.140 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H]1CCCC(F)(F)C1)CCC2 ZINC000332252446 336165156 /nfs/dbraw/zinc/16/51/56/336165156.db2.gz YBMLBHQSWCQMOH-WFASDCNBSA-N 0 3 310.344 4.140 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCc2c1cccc2F ZINC000532462993 336248891 /nfs/dbraw/zinc/24/88/91/336248891.db2.gz RLWBKGMEIXDGMD-KPZWWZAWSA-N 0 3 314.360 4.380 20 5 DIBDHN CCCNc1ccc(CNCc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000193155351 336563981 /nfs/dbraw/zinc/56/39/81/336563981.db2.gz PLMLIGMHVDOGLZ-UHFFFAOYSA-N 0 3 313.401 4.015 20 5 DIBDHN CC[C@@H](N[C@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358377620 336627269 /nfs/dbraw/zinc/62/72/69/336627269.db2.gz JJSLTBFJZYEHQT-MSOLQXFVSA-N 0 3 311.385 4.182 20 5 DIBDHN CCO[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000193432446 336896899 /nfs/dbraw/zinc/89/68/99/336896899.db2.gz PBLNRNZRBWSEJC-KSSFIOAISA-N 0 3 314.385 4.023 20 5 DIBDHN CC[C@H](NCc1ccc(C)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000177987199 337159488 /nfs/dbraw/zinc/15/94/88/337159488.db2.gz AXRCXLYQVHDANV-KRWDZBQOSA-N 0 3 314.385 4.153 20 5 DIBDHN C[C@H](NCc1cc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000536851058 337745324 /nfs/dbraw/zinc/74/53/24/337745324.db2.gz IHGBLQHHTBQIDB-LBPRGKRZSA-N 0 3 316.426 4.386 20 5 DIBDHN CN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccc2[nH]ccc21 ZINC000426389014 338030146 /nfs/dbraw/zinc/03/01/46/338030146.db2.gz JTJMPGQIMXETDI-YVMONPNESA-N 0 3 321.380 4.221 20 5 DIBDHN CSC[C@H]1CCCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000430200282 338101035 /nfs/dbraw/zinc/10/10/35/338101035.db2.gz UGCCMBJFTYATOY-IDJPSDCMSA-N 0 3 320.458 4.073 20 5 DIBDHN Cc1cccc(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000433131812 338182592 /nfs/dbraw/zinc/18/25/92/338182592.db2.gz DJLWSQYBRVFKJO-SFHVURJKSA-N 0 3 310.397 4.415 20 5 DIBDHN Cc1ccc(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000433164536 338183766 /nfs/dbraw/zinc/18/37/66/338183766.db2.gz RNBDCQLUCIMYHF-INIZCTEOSA-N 0 3 316.426 4.477 20 5 DIBDHN C[C@H]1[C@@H](c2ccccc2)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000434900336 338227291 /nfs/dbraw/zinc/22/72/91/338227291.db2.gz CWHJGZXJUHUNEX-ZFWWWQNUSA-N 0 3 314.360 4.112 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NC1(c3ccccc3)CC1)CCC2 ZINC000447589503 338560137 /nfs/dbraw/zinc/56/01/37/338560137.db2.gz XYQZLBCVDICPEH-GOSISDBHSA-N 0 3 308.381 4.251 20 5 DIBDHN CC[C@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000449136969 338596185 /nfs/dbraw/zinc/59/61/85/338596185.db2.gz WQEDJQKCLHEOBP-FZMZJTMJSA-N 0 3 319.430 4.032 20 5 DIBDHN CC[C@@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000449136971 338596299 /nfs/dbraw/zinc/59/62/99/338596299.db2.gz WQEDJQKCLHEOBP-SMDDNHRTSA-N 0 3 319.430 4.032 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](NCCCCF)c2ccccc2)c1 ZINC000462806197 339090280 /nfs/dbraw/zinc/09/02/80/339090280.db2.gz GCWHFEYMKMUBGD-QGZVFWFLSA-N 0 3 302.349 4.024 20 5 DIBDHN CCCN(CCc1cccs1)Cc1ccccc1[N+](=O)[O-] ZINC000464593817 339146637 /nfs/dbraw/zinc/14/66/37/339146637.db2.gz OSQYPRODOSSEKR-UHFFFAOYSA-N 0 3 304.415 4.111 20 5 DIBDHN CCS[C@H]1CC[C@@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464781276 339153331 /nfs/dbraw/zinc/15/33/31/339153331.db2.gz XXAPCKZLKPPIAX-CABCVRRESA-N 0 3 308.447 4.009 20 5 DIBDHN Cc1cccc(OC[C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000467834918 339247201 /nfs/dbraw/zinc/24/72/01/339247201.db2.gz XBHFJJFLDOGJHG-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN C[C@H](Cc1ccccc1F)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000467835110 339247248 /nfs/dbraw/zinc/24/72/48/339247248.db2.gz YMPDYERXTWGUMW-CHWSQXEVSA-N 0 3 302.349 4.016 20 5 DIBDHN Cc1ccc(O[C@H](C)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000467861604 339247870 /nfs/dbraw/zinc/24/78/70/339247870.db2.gz HTJFHTFIHGXCTC-CABCVRRESA-N 0 3 314.385 4.021 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@@H]1c1ccccc1 ZINC000470172981 339312668 /nfs/dbraw/zinc/31/26/68/339312668.db2.gz GKTJZNGCBASIOQ-LJQBUTKESA-N 0 3 308.381 4.445 20 5 DIBDHN C[C@H](CNCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000470195764 339313778 /nfs/dbraw/zinc/31/37/78/339313778.db2.gz QPORQAACCINCLB-GFCCVEGCSA-N 0 3 304.777 4.142 20 5 DIBDHN Cc1c(CN[C@H]2CCc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000478513015 339516868 /nfs/dbraw/zinc/51/68/68/339516868.db2.gz HGFVEIYOIMFCQO-INIZCTEOSA-N 0 3 316.788 4.334 20 5 DIBDHN Cc1ccc(O[C@@H](C)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000483631057 339670104 /nfs/dbraw/zinc/67/01/04/339670104.db2.gz CJLKDHNXRTUIQP-LSDHHAIUSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC(c2ccsc2)CC1 ZINC000486895526 339737423 /nfs/dbraw/zinc/73/74/23/339737423.db2.gz CHIZSDMYMYEIAM-UHFFFAOYSA-N 0 3 316.426 4.344 20 5 DIBDHN C[C@H](N[C@@H]1CS[C@H](C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000488412907 339780520 /nfs/dbraw/zinc/78/05/20/339780520.db2.gz DTFNIVRCWZTPIL-WHOFXGATSA-N 0 3 308.447 4.166 20 5 DIBDHN CC(C)(NC[C@H]1C[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000492397778 339899532 /nfs/dbraw/zinc/89/95/32/339899532.db2.gz LBTTVODISVGDFN-HZPDHXFCSA-N 0 3 310.397 4.223 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC=CCC2)c2ccccc2)c1 ZINC000494039519 339939583 /nfs/dbraw/zinc/93/95/83/339939583.db2.gz PHYJACDVUSSVRG-IEBWSBKVSA-N 0 3 308.381 4.383 20 5 DIBDHN CC(C)c1ccc2c(c1)[C@@H](NCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000495156122 339976882 /nfs/dbraw/zinc/97/68/82/339976882.db2.gz LIKGNSRJJVUTTM-IBGZPJMESA-N 0 3 310.397 4.495 20 5 DIBDHN CCNCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000499952696 340047519 /nfs/dbraw/zinc/04/75/19/340047519.db2.gz GKHLWBXGPFJSJM-UHFFFAOYSA-N 0 3 302.399 4.164 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1cccc2[nH]ccc21 ZINC000506732242 340200336 /nfs/dbraw/zinc/20/03/36/340200336.db2.gz VGXNBZKGPRCYFJ-ZDUSSCGKSA-N 0 3 309.369 4.269 20 5 DIBDHN O=[N+]([O-])c1cccc(CN(Cc2cccc3[nH]ccc32)C2CC2)c1 ZINC000507172595 340211113 /nfs/dbraw/zinc/21/11/13/340211113.db2.gz FWGBPMKTNOUSQU-UHFFFAOYSA-N 0 3 321.380 4.241 20 5 DIBDHN C[C@@H](c1cccs1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507442259 340219742 /nfs/dbraw/zinc/21/97/42/340219742.db2.gz OBPSXGPPHFHHEV-LJLILKBBSA-N 0 3 302.399 4.363 20 5 DIBDHN CCS[C@@H]1CCCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000303495289 340328161 /nfs/dbraw/zinc/32/81/61/340328161.db2.gz WYSUPLYSTXOGJI-XJKSGUPXSA-N 0 3 308.447 4.263 20 5 DIBDHN CC(C)c1ccc(CNCC2(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000512909393 340383663 /nfs/dbraw/zinc/38/36/63/340383663.db2.gz XYVRRDSSYNOHDO-UHFFFAOYSA-N 0 3 316.323 4.150 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)c1ccc2n[nH]cc2c1 ZINC000513189418 340396081 /nfs/dbraw/zinc/39/60/81/340396081.db2.gz YAMLBKKOAOGHRR-QWHCGFSZSA-N 0 3 324.384 4.191 20 5 DIBDHN COc1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000540160863 340919030 /nfs/dbraw/zinc/91/90/30/340919030.db2.gz PHSZPRQLLADOFT-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN Cc1ccc(SCCN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000540189380 340922350 /nfs/dbraw/zinc/92/23/50/340922350.db2.gz BWYXQQYFLRFUAG-CQSZACIVSA-N 0 3 316.426 4.346 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000546165539 341155419 /nfs/dbraw/zinc/15/54/19/341155419.db2.gz CNYJMPMMAVBFST-ZYHUDNBSSA-N 0 3 304.312 4.285 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@]1(C)CCCc2ccccc21 ZINC000546580862 341173410 /nfs/dbraw/zinc/17/34/10/341173410.db2.gz WEPFYRJYFPTXGN-IBGZPJMESA-N 0 3 310.397 4.245 20 5 DIBDHN CC[C@@H](CC(F)(F)F)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000546873234 341184720 /nfs/dbraw/zinc/18/47/20/341184720.db2.gz QYKGDHJEZNCXBA-QWRGUYRKSA-N 0 3 304.312 4.285 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CNC1(c2cccc(F)c2)CC1 ZINC000237738631 341219374 /nfs/dbraw/zinc/21/93/74/341219374.db2.gz IQQVIVMYNPJRDK-GQCTYLIASA-N 0 3 312.344 4.026 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000079121492 341253994 /nfs/dbraw/zinc/25/39/94/341253994.db2.gz QHSFMCYWTYXQPC-QWHCGFSZSA-N 0 3 302.349 4.454 20 5 DIBDHN CC(C)[C@@H]1CC[C@@H]1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000552055935 341365619 /nfs/dbraw/zinc/36/56/19/341365619.db2.gz JXAQTIIMHZUCTN-KBPBESRZSA-N 0 3 316.323 4.138 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC3(CCC3)C2)o1 ZINC000552064544 341366731 /nfs/dbraw/zinc/36/67/31/341366731.db2.gz YSICKPCDEIEVDF-UHFFFAOYSA-N 0 3 312.369 4.231 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)cc1[N+](=O)[O-] ZINC000552339810 341387817 /nfs/dbraw/zinc/38/78/17/341387817.db2.gz DPHHQRRFGHZBRN-OLZOCXBDSA-N 0 3 324.384 4.191 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000552515104 341397121 /nfs/dbraw/zinc/39/71/21/341397121.db2.gz YJKCHBZUIOBMEX-XJKSGUPXSA-N 0 3 314.360 4.284 20 5 DIBDHN CC[C@@H](NCc1cnc2ccccc2c1)c1cccc([N+](=O)[O-])c1 ZINC000337197534 522890536 /nfs/dbraw/zinc/89/05/36/522890536.db2.gz YQXXLVBHXFJJNO-GOSISDBHSA-N 0 3 321.380 4.384 20 5 DIBDHN C[C@@H](N[C@@H]1CCSc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000192834627 525650006 /nfs/dbraw/zinc/65/00/06/525650006.db2.gz QTJLAXOFAASFTA-MLGOLLRUSA-N 0 3 314.410 4.483 20 5 DIBDHN CSCc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000188715691 525738639 /nfs/dbraw/zinc/73/86/39/525738639.db2.gz RVCHETCQEILRHZ-CYBMUJFWSA-N 0 3 316.426 4.309 20 5 DIBDHN CN(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCCCCCC1 ZINC001167302423 1036557247 /nfs/dbraw/zinc/55/72/47/1036557247.db2.gz PUAANCOXULMZOA-UHFFFAOYSA-N 0 3 321.377 4.048 20 5 DIBDHN CN(CCc1ccccc1F)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001167337917 1036807055 /nfs/dbraw/zinc/80/70/55/1036807055.db2.gz YENINDDAOMUTMI-UHFFFAOYSA-N 0 3 322.767 4.062 20 5 DIBDHN CC[C@H](C)[C@@H](C)N(Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CC1 ZINC001167356103 1036962284 /nfs/dbraw/zinc/96/22/84/1036962284.db2.gz JKSYBZKBRWYUQV-NWDGAFQWSA-N 0 3 324.396 4.142 20 5 DIBDHN CC[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC001167377991 1037041229 /nfs/dbraw/zinc/04/12/29/1037041229.db2.gz XTXZEFMSDFRJLN-HNNXBMFYSA-N 0 3 320.433 4.394 20 5 DIBDHN CCC[C@@H](NCc1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000126116433 1037382907 /nfs/dbraw/zinc/38/29/07/1037382907.db2.gz JKNDUDYTACJFFY-GOSISDBHSA-N 0 3 314.385 4.234 20 5 DIBDHN COc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)ccc1C ZINC000177986674 1037573740 /nfs/dbraw/zinc/57/37/40/1037573740.db2.gz YEDJMLXTEIFFFT-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]1c1cccnc1 ZINC000581396392 1037580731 /nfs/dbraw/zinc/58/07/31/1037580731.db2.gz AECGVEWHEOHYHZ-HVEPWOEZSA-N 0 3 323.396 4.230 20 5 DIBDHN CC(C)(NCc1ccccc1C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000610575214 1037640145 /nfs/dbraw/zinc/64/01/45/1037640145.db2.gz OUHXEKKATDTHMV-UHFFFAOYSA-N 0 3 310.397 4.497 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc3cccnc3c2)cc1[N+](=O)[O-] ZINC000610518235 1037808632 /nfs/dbraw/zinc/80/86/32/1037808632.db2.gz XABJGQVIVULBKY-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CC[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000178089099 1037813433 /nfs/dbraw/zinc/81/34/33/1037813433.db2.gz JYYDXLBHVPJOEP-QZTJIDSGSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1c(CN2CCC[C@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000051230727 1038003601 /nfs/dbraw/zinc/00/36/01/1038003601.db2.gz SCRANTIOZRXECJ-HNNXBMFYSA-N 0 3 302.399 4.302 20 5 DIBDHN CC[C@@H](C)[C@@H]1CCCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582168 1038203815 /nfs/dbraw/zinc/20/38/15/1038203815.db2.gz FMNRXWVGYZTTOT-DOMZBBRYSA-N 0 3 317.389 4.137 20 5 DIBDHN CSc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178649729 1038847355 /nfs/dbraw/zinc/84/73/55/1038847355.db2.gz KFDUGDPXPQEQLO-GFCCVEGCSA-N 0 3 302.399 4.168 20 5 DIBDHN C[C@@H](N(C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)(C)C ZINC000534113291 1038985743 /nfs/dbraw/zinc/98/57/43/1038985743.db2.gz AOBCGUUODWZDLT-GFCCVEGCSA-N 0 3 317.389 4.116 20 5 DIBDHN C[C@H](N(C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)(C)C ZINC000534113302 1038986044 /nfs/dbraw/zinc/98/60/44/1038986044.db2.gz AOBCGUUODWZDLT-LBPRGKRZSA-N 0 3 317.389 4.116 20 5 DIBDHN CC(C)Oc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000079723943 1039183954 /nfs/dbraw/zinc/18/39/54/1039183954.db2.gz ZGPLGFFQFRQBPO-CQSZACIVSA-N 0 3 314.385 4.233 20 5 DIBDHN Cc1c(CNCc2ccc3c(c2)CCCC3)cccc1[N+](=O)[O-] ZINC000491385903 1039835980 /nfs/dbraw/zinc/83/59/80/1039835980.db2.gz GVTJXQNVAGJYCK-UHFFFAOYSA-N 0 3 310.397 4.072 20 5 DIBDHN CCN(Cc1c[nH]c2ccccc12)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000443851563 1039891594 /nfs/dbraw/zinc/89/15/94/1039891594.db2.gz IRHMTWWHIGTJSG-UHFFFAOYSA-N 0 3 323.396 4.407 20 5 DIBDHN COc1cc(CN[C@H](C)c2cc(C)cc(C)c2)ccc1[N+](=O)[O-] ZINC000492855665 1040032083 /nfs/dbraw/zinc/03/20/83/1040032083.db2.gz ZDJXMEYWICPOTA-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN CC(C)CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000236699447 1040639045 /nfs/dbraw/zinc/63/90/45/1040639045.db2.gz ORZFQNZJMHKXTA-UHFFFAOYSA-N 0 3 319.430 4.244 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000092856834 1041119941 /nfs/dbraw/zinc/11/99/41/1041119941.db2.gz KCXHVUFFBZMMBM-KPZWWZAWSA-N 0 3 314.360 4.462 20 5 DIBDHN CCN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CC1 ZINC000809945880 1041276603 /nfs/dbraw/zinc/27/66/03/1041276603.db2.gz FWNAZXIZSNDGOT-UHFFFAOYSA-N 0 3 303.189 4.134 20 5 DIBDHN C[C@@H](N[C@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000051100076 1041424886 /nfs/dbraw/zinc/42/48/86/1041424886.db2.gz BEDMVXRHUOBZNB-BZNIZROVSA-N 0 3 302.399 4.458 20 5 DIBDHN C[C@H](N[C@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000051100075 1041427161 /nfs/dbraw/zinc/42/71/61/1041427161.db2.gz BEDMVXRHUOBZNB-ZBEGNZNMSA-N 0 3 302.399 4.458 20 5 DIBDHN CC[C@H](c1ccncc1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290496680 1041511567 /nfs/dbraw/zinc/51/15/67/1041511567.db2.gz OVZPKGKQSCMJGH-DBWMJRBXSA-N 0 3 311.385 4.086 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccsc1)CCCC2 ZINC000417333303 1041658728 /nfs/dbraw/zinc/65/87/28/1041658728.db2.gz YTMCAMTYBNTKKK-INIZCTEOSA-N 0 3 302.399 4.214 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1F ZINC000815587887 1041968428 /nfs/dbraw/zinc/96/84/28/1041968428.db2.gz WTDOKRICAYKOFF-VXGBXAGGSA-N 0 3 317.364 4.036 20 5 DIBDHN Cc1c(CN[C@@H](C)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000048334969 1041989567 /nfs/dbraw/zinc/98/95/67/1041989567.db2.gz WGXURXTYWFHETH-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN CCC[C@@H](NCc1cnc(C)cc1C)c1cccc([N+](=O)[O-])c1 ZINC000397091959 1042175648 /nfs/dbraw/zinc/17/56/48/1042175648.db2.gz KNFLWYPNCXRUHF-GOSISDBHSA-N 0 3 313.401 4.238 20 5 DIBDHN CC[C@](C)(NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000107717967 1042302931 /nfs/dbraw/zinc/30/29/31/1042302931.db2.gz AUNOJCHNROFWEE-SFHVURJKSA-N 0 3 314.385 4.018 20 5 DIBDHN CCC[C@H](N[C@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000231791864 1042628032 /nfs/dbraw/zinc/62/80/32/1042628032.db2.gz SIQFOPBHUVMPJN-MFKMUULPSA-N 0 3 304.312 4.367 20 5 DIBDHN CCc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)s1 ZINC000231884444 1042668122 /nfs/dbraw/zinc/66/81/22/1042668122.db2.gz NVANYRPECCCSEC-GFCCVEGCSA-N 0 3 304.415 4.378 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]1C(C)C ZINC000517094433 1042867098 /nfs/dbraw/zinc/86/70/98/1042867098.db2.gz UMNUPJNDVPLSCY-INIZCTEOSA-N 0 3 306.406 4.002 20 5 DIBDHN C[C@H](N[C@@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000178649381 1043134337 /nfs/dbraw/zinc/13/43/37/1043134337.db2.gz KEIHGVVPZULQTE-APPDUMDISA-N 0 3 300.333 4.072 20 5 DIBDHN CCOc1cccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178651299 1043135462 /nfs/dbraw/zinc/13/54/62/1043135462.db2.gz PLAQSKLGORRNNW-KBPBESRZSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441490046 1043182289 /nfs/dbraw/zinc/18/22/89/1043182289.db2.gz VJVKKZFKJCHAHN-XUJVJEKNSA-N 0 3 308.809 4.401 20 5 DIBDHN C[C@@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000866607851 1043232554 /nfs/dbraw/zinc/23/25/54/1043232554.db2.gz VQRJKFJMVMXYCY-RAIGVLPGSA-N 0 3 314.307 4.143 20 5 DIBDHN CC[C@H](N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1 ZINC000192895635 1043276951 /nfs/dbraw/zinc/27/69/51/1043276951.db2.gz RUMBAPLYEFHRPS-ZWKOTPCHSA-N 0 3 311.385 4.108 20 5 DIBDHN CC[C@H](N[C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1 ZINC000192895667 1043278152 /nfs/dbraw/zinc/27/81/52/1043278152.db2.gz RUMBAPLYEFHRPS-ROUUACIJSA-N 0 3 311.385 4.108 20 5 DIBDHN CC(C)OC1CCC(N[C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872051485 1043435989 /nfs/dbraw/zinc/43/59/89/1043435989.db2.gz JDANCJJVYNBBAF-HSBZDZAISA-N 0 3 324.396 4.121 20 5 DIBDHN Cc1c(CNCc2csc3ccccc23)cccc1[N+](=O)[O-] ZINC000389592762 1043551536 /nfs/dbraw/zinc/55/15/36/1043551536.db2.gz IFNQQZBUJWWNHJ-UHFFFAOYSA-N 0 3 312.394 4.408 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc(CF)cc2)cc1[N+](=O)[O-] ZINC000777725191 1043784964 /nfs/dbraw/zinc/78/49/64/1043784964.db2.gz HGQOKCXEHJITJV-ZDUSSCGKSA-N 0 3 302.349 4.224 20 5 DIBDHN C[C@@H](CN(C)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000522549682 1044043687 /nfs/dbraw/zinc/04/36/87/1044043687.db2.gz FYSIDKCTQKGGMZ-ZDUSSCGKSA-N 0 3 318.804 4.484 20 5 DIBDHN CCc1cnccc1[C@@H](C)N[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000359315258 1044154304 /nfs/dbraw/zinc/15/43/04/1044154304.db2.gz SFGHROWYKKYOHH-FZKQIMNGSA-N 0 3 313.401 4.354 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCC3=CCCCC3)o2)c1 ZINC001202595283 1044368497 /nfs/dbraw/zinc/36/84/97/1044368497.db2.gz RRZBIQYACXPWGL-UHFFFAOYSA-N 0 3 312.369 4.445 20 5 DIBDHN CCOc1ccc([C@@H](C)N[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000089552858 1044742164 /nfs/dbraw/zinc/74/21/64/1044742164.db2.gz NYZKCMXDYBMNNI-UONOGXRCSA-N 0 3 314.385 4.405 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000445878434 1044843298 /nfs/dbraw/zinc/84/32/98/1044843298.db2.gz SICAACHIDUCAQZ-NSHDSACASA-N 0 3 324.730 4.315 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1F ZINC000447535770 1045141661 /nfs/dbraw/zinc/14/16/61/1045141661.db2.gz IHCOKJILVQTWPU-GOSISDBHSA-N 0 3 314.360 4.210 20 5 DIBDHN CCc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000447546482 1045144834 /nfs/dbraw/zinc/14/48/34/1045144834.db2.gz WJTZMFIAYHNLGV-KRWDZBQOSA-N 0 3 316.426 4.386 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CCC(CF)CC3)o2)c1 ZINC000449462149 1045400007 /nfs/dbraw/zinc/40/00/07/1045400007.db2.gz UOMIKJQHFMVFNF-UHFFFAOYSA-N 0 3 318.348 4.036 20 5 DIBDHN Cc1ccccc1[C@@H]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801515104 1045727575 /nfs/dbraw/zinc/72/75/75/1045727575.db2.gz WWAHRPVEYZGFND-OAHLLOKOSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801522049 1045730732 /nfs/dbraw/zinc/73/07/32/1045730732.db2.gz XZRDHSVIBFGBQR-CJNGLKHVSA-N 0 3 314.360 4.112 20 5 DIBDHN CCOc1cc(CN[C@@H](C)c2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000755048760 1045949676 /nfs/dbraw/zinc/94/96/76/1045949676.db2.gz PUEIBMIPOUKSKR-LBPRGKRZSA-N 0 3 320.414 4.214 20 5 DIBDHN CC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000453228749 1045994117 /nfs/dbraw/zinc/99/41/17/1045994117.db2.gz BZSQMFVLYHKDIM-UGSOOPFHSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@@H](N[C@@H]1CCCc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1 ZINC000453238494 1045999096 /nfs/dbraw/zinc/99/90/96/1045999096.db2.gz QJDUWLLKKQTOAC-KZULUSFZSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1cc(CNCc2c3ccccc3cc3ccccc32)ncn1 ZINC000756989839 1046158371 /nfs/dbraw/zinc/15/83/71/1046158371.db2.gz HSSKFVYUPXJKGR-UHFFFAOYSA-N 0 3 313.404 4.381 20 5 DIBDHN C[C@H](CN[C@@H](C)c1ccncc1Cl)c1ccccc1[N+](=O)[O-] ZINC000903246211 1046207519 /nfs/dbraw/zinc/20/75/19/1046207519.db2.gz SGNHPNMZQSJWAL-NEPJUHHUSA-N 0 3 319.792 4.098 20 5 DIBDHN C[C@@H](CN[C@H](C)c1cccnc1Cl)c1ccccc1[N+](=O)[O-] ZINC000903244845 1046207557 /nfs/dbraw/zinc/20/75/57/1046207557.db2.gz FJLTWJUVOTYQHZ-NWDGAFQWSA-N 0 3 319.792 4.098 20 5 DIBDHN C[C@@H](CN[C@@H](C)c1ccncc1Cl)c1ccccc1[N+](=O)[O-] ZINC000903246213 1046208155 /nfs/dbraw/zinc/20/81/55/1046208155.db2.gz SGNHPNMZQSJWAL-RYUDHWBXSA-N 0 3 319.792 4.098 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)NCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782543732 1046536278 /nfs/dbraw/zinc/53/62/78/1046536278.db2.gz OHCSVFOBTCRNJF-LLVKDONJSA-N 0 3 324.730 4.315 20 5 DIBDHN Cc1cc(F)ccc1[C@@H](C)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000834813994 1046674583 /nfs/dbraw/zinc/67/45/83/1046674583.db2.gz BZPJSMVAEYTJSH-QWHCGFSZSA-N 0 3 302.349 4.454 20 5 DIBDHN C[C@H](Cc1ccc(Cl)cc1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000303931723 1047007452 /nfs/dbraw/zinc/00/74/52/1047007452.db2.gz XIPOQSICXWRLQN-CYBMUJFWSA-N 0 3 318.804 4.311 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2CN1CCOCC12CC2 ZINC001141728562 1047281703 /nfs/dbraw/zinc/28/17/03/1047281703.db2.gz WZRWYNHJJAGCBI-UHFFFAOYSA-N 0 3 303.405 4.358 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN(CC[C@H]1CCCC1(F)F)C1CC1 ZINC001168316543 1047425703 /nfs/dbraw/zinc/42/57/03/1047425703.db2.gz CMHDDQGOHQMSAA-CQSZACIVSA-N 0 3 324.371 4.385 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H]1CSc2ccccc21 ZINC000538400310 1047672143 /nfs/dbraw/zinc/67/21/43/1047672143.db2.gz OINGZALERZKWRZ-ZKKXHLJNSA-N 0 3 312.394 4.045 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@H]1CSc2ccccc21 ZINC000538400309 1047672171 /nfs/dbraw/zinc/67/21/71/1047672171.db2.gz OINGZALERZKWRZ-PKYBCLHXSA-N 0 3 312.394 4.045 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](c1cccnc1)C1CC1 ZINC000539051928 1047727352 /nfs/dbraw/zinc/72/73/52/1047727352.db2.gz PULUJLDFHZVBDA-ACJLOTCBSA-N 0 3 311.385 4.100 20 5 DIBDHN COc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)c1 ZINC000539064758 1047730312 /nfs/dbraw/zinc/73/03/12/1047730312.db2.gz DLVWRSSVUUYBCI-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN CC(C)[C@H](Cc1ccccc1)NCc1c(F)cccc1[N+](=O)[O-] ZINC001197759241 1047873699 /nfs/dbraw/zinc/87/36/99/1047873699.db2.gz PHRMFRQBEFQSCP-KRWDZBQOSA-N 0 3 316.376 4.091 20 5 DIBDHN C/C=C/C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC001175052528 1048111777 /nfs/dbraw/zinc/11/17/77/1048111777.db2.gz GXNFIRMPJFWMIV-SJDLMVEWSA-N 0 3 318.417 4.172 20 5 DIBDHN C[C@H](N[C@@H]1CCSc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000192834613 1048319584 /nfs/dbraw/zinc/31/95/84/1048319584.db2.gz QTJLAXOFAASFTA-BLLLJJGKSA-N 0 3 314.410 4.483 20 5 DIBDHN C[C@@H](N[C@H]1CCSc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000192834653 1048319745 /nfs/dbraw/zinc/31/97/45/1048319745.db2.gz QTJLAXOFAASFTA-WBMJQRKESA-N 0 3 314.410 4.483 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCCC(F)(F)CC1 ZINC000600187102 1048384689 /nfs/dbraw/zinc/38/46/89/1048384689.db2.gz DJFQKJMIBMDITL-RAXLEYEMSA-N 0 3 310.344 4.119 20 5 DIBDHN CC(C)c1ccc(CN2CCSCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000483416955 1048790473 /nfs/dbraw/zinc/79/04/73/1048790473.db2.gz HGJUCGFRLUXVOD-ZDUSSCGKSA-N 0 3 308.447 4.046 20 5 DIBDHN C[C@H](CCCC(F)(F)F)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000775528503 1049107919 /nfs/dbraw/zinc/10/79/19/1049107919.db2.gz YYXDXXYPMVTBAB-SECBINFHSA-N 0 3 324.730 4.459 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1Cc2ccccc2C[C@@H]1C ZINC001180091679 1049263080 /nfs/dbraw/zinc/26/30/80/1049263080.db2.gz DCPQTMSZBCFUNT-IZNAZMGOSA-N 0 3 322.408 4.445 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1Cc2ccccc2C[C@H]1C ZINC001180091678 1049263860 /nfs/dbraw/zinc/26/38/60/1049263860.db2.gz DCPQTMSZBCFUNT-DDITZMBXSA-N 0 3 322.408 4.445 20 5 DIBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CN1CCCCCCC1 ZINC001205107918 1049380762 /nfs/dbraw/zinc/38/07/62/1049380762.db2.gz LJNZEMNFWDFLOG-UHFFFAOYSA-N 0 3 316.323 4.380 20 5 DIBDHN CC(C)(NCCSC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC001194683193 1049410297 /nfs/dbraw/zinc/41/02/97/1049410297.db2.gz LWADSBAMZKLHIF-UHFFFAOYSA-N 0 3 322.474 4.485 20 5 DIBDHN CCCC[C@@H](C)N(C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001194873999 1049440664 /nfs/dbraw/zinc/44/06/64/1049440664.db2.gz NLQUJVOMAMSJGV-CQSZACIVSA-N 0 3 308.422 4.393 20 5 DIBDHN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCC[C@@H](C)C1 ZINC001195179674 1049484088 /nfs/dbraw/zinc/48/40/88/1049484088.db2.gz OHCPSMLATJZGAX-FRRDWIJNSA-N 0 3 317.389 4.040 20 5 DIBDHN CC[C@H]1CCCC[C@@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001206055736 1049642493 /nfs/dbraw/zinc/64/24/93/1049642493.db2.gz MBSRRLLURPRULW-QWHCGFSZSA-N 0 3 317.389 4.042 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cccc3[nH]ccc32)cc1[N+](=O)[O-] ZINC000175057249 1049648292 /nfs/dbraw/zinc/64/82/92/1049648292.db2.gz WSRNMOUEOQAKDB-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN CCCCOC1CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000490085714 1049801967 /nfs/dbraw/zinc/80/19/67/1049801967.db2.gz KJUKXXXNNWAGQK-HNNXBMFYSA-N 0 3 320.433 4.245 20 5 DIBDHN Cc1cc2cc3cc(C)c(Nc4ccnnc4)cc3nc2cc1N ZINC001209963196 1050112379 /nfs/dbraw/zinc/11/23/79/1050112379.db2.gz MYWHEMSULVNVRN-UHFFFAOYSA-N 0 3 315.380 4.121 20 5 DIBDHN Cc1ccccc1C1(N[C@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594506868 1050521593 /nfs/dbraw/zinc/52/15/93/1050521593.db2.gz GAIRLPVCCMPVNU-KRWDZBQOSA-N 0 3 308.381 4.169 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@]2(CC2(F)F)C1 ZINC000846105055 1050669859 /nfs/dbraw/zinc/66/98/59/1050669859.db2.gz POBGKBOUKSNSOA-LPDYGMJQSA-N 0 3 322.355 4.119 20 5 DIBDHN CC[C@@H](Cc1ccccc1)N(C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000741800447 1050745561 /nfs/dbraw/zinc/74/55/61/1050745561.db2.gz LMNLDUCAJGPQHZ-KRWDZBQOSA-N 0 3 316.376 4.187 20 5 DIBDHN Cc1ccc(CC[C@@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000742379500 1050839823 /nfs/dbraw/zinc/83/98/23/1050839823.db2.gz CWLNYIGFZVJJCI-LLVKDONJSA-N 0 3 322.792 4.261 20 5 DIBDHN CC[C@@H](NCc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000036921215 1051101932 /nfs/dbraw/zinc/10/19/32/1051101932.db2.gz HFVHKAUNJGNXLH-MRXNPFEDSA-N 0 3 304.777 4.489 20 5 DIBDHN CC[C@@H](NCc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000037010567 1051105730 /nfs/dbraw/zinc/10/57/30/1051105730.db2.gz JNVXXHQPLIJZAX-MRXNPFEDSA-N 0 3 304.777 4.489 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H]2CC2CCCC2)c(F)c1 ZINC001171632354 1051174361 /nfs/dbraw/zinc/17/43/61/1051174361.db2.gz YRVOAVNNZRXJDZ-HNNXBMFYSA-N 0 3 306.381 4.279 20 5 DIBDHN CCCC[C@H]1CCC[C@H]1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC001168980091 1051477022 /nfs/dbraw/zinc/47/70/22/1051477022.db2.gz IDRKYFFLSBCZPY-MEDUHNTESA-N 0 3 312.360 4.322 20 5 DIBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1cc(F)ccc1Cl ZINC001173215691 1051633117 /nfs/dbraw/zinc/63/31/17/1051633117.db2.gz YQAHVNOIDSKZKY-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(C)Cc1ccccc1Cl ZINC001173225039 1051638906 /nfs/dbraw/zinc/63/89/06/1051638906.db2.gz BAXLBOJTNKZGNL-CYBMUJFWSA-N 0 3 318.804 4.311 20 5 DIBDHN Cc1cc(C)c2ccc3cccc(O[C@H]4CCNC[C@@H]4F)c3c2n1 ZINC001218073113 1052192777 /nfs/dbraw/zinc/19/27/77/1052192777.db2.gz YWURGIATTRTVRR-IRXDYDNUSA-N 0 3 324.399 4.084 20 5 DIBDHN C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000495401930 1052336436 /nfs/dbraw/zinc/33/64/36/1052336436.db2.gz OYAPOYPFDDWDKC-CHWSQXEVSA-N 0 3 302.349 4.016 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000316746156 1052472425 /nfs/dbraw/zinc/47/24/25/1052472425.db2.gz PVJIOKVQPOEAOB-OLZOCXBDSA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1csc([N+](=O)[O-])c1 ZINC000609672651 1052986175 /nfs/dbraw/zinc/98/61/75/1052986175.db2.gz NUUWLGIDODNSLW-WFASDCNBSA-N 0 3 302.399 4.034 20 5 DIBDHN Cc1c(CNC(C)(C)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000179576686 1053016281 /nfs/dbraw/zinc/01/62/81/1053016281.db2.gz AIUYYQXURQELNG-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN CCCC[C@H]1CCC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000617220452 1053117633 /nfs/dbraw/zinc/11/76/33/1053117633.db2.gz BEVIRLWPHINCMU-GXTWGEPZSA-N 0 3 317.389 4.185 20 5 DIBDHN CCCC[C@@H]1CCC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000617220454 1053117921 /nfs/dbraw/zinc/11/79/21/1053117921.db2.gz BEVIRLWPHINCMU-OCCSQVGLSA-N 0 3 317.389 4.185 20 5 DIBDHN CC(C)c1ccc(CNCc2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001321652711 1053425643 /nfs/dbraw/zinc/42/56/43/1053425643.db2.gz CJNJOXPKCHCGBF-UHFFFAOYSA-N 0 3 324.424 4.497 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000619754176 1053547471 /nfs/dbraw/zinc/54/74/71/1053547471.db2.gz LUKXPAZBTFQZCU-MEDUHNTESA-N 0 3 302.399 4.385 20 5 DIBDHN C[C@@H](N[C@H]1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC000081181377 1053990925 /nfs/dbraw/zinc/99/09/25/1053990925.db2.gz DLRNCIRPOHFQBB-DIFFPNOSSA-N 0 3 300.333 4.072 20 5 DIBDHN CC[C@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001347668252 1054575114 /nfs/dbraw/zinc/57/51/14/1054575114.db2.gz KOMQEFYSGCGKOF-BZNIZROVSA-N 0 3 317.364 4.118 20 5 DIBDHN CC(C)c1ccc(CNCc2cc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000131464279 1055777207 /nfs/dbraw/zinc/77/72/07/1055777207.db2.gz KEHVURCUEDKDMT-UHFFFAOYSA-N 0 3 323.396 4.489 20 5 DIBDHN CCOc1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC001620818407 1056089506 /nfs/dbraw/zinc/08/95/06/1056089506.db2.gz VCOFVHKIHVWJSH-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN CC(C)N(CCOCC1CCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001615264532 1056484642 /nfs/dbraw/zinc/48/46/42/1056484642.db2.gz CGHZZCDMBJOMSF-UHFFFAOYSA-N 0 3 320.433 4.012 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@@H]1CCC[C@H](C)C1 ZINC001615302739 1056488941 /nfs/dbraw/zinc/48/89/41/1056488941.db2.gz JOGUBQJUVNWETD-GOEBONIOSA-N 0 3 320.433 4.393 20 5 DIBDHN CCC1CCC(N(C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC001615789374 1056576345 /nfs/dbraw/zinc/57/63/45/1056576345.db2.gz LRADUSSBTPCUSI-UHFFFAOYSA-N 0 3 324.396 4.143 20 5 DIBDHN C[C@@H](Cc1cccs1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001615818219 1056579894 /nfs/dbraw/zinc/57/98/94/1056579894.db2.gz REHIKYUCKULZPI-NSHDSACASA-N 0 3 324.833 4.373 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCCCC[C@@H]1C ZINC001617339649 1056817170 /nfs/dbraw/zinc/81/71/70/1056817170.db2.gz ZFGJFOTZDXBFLM-AWEZNQCLSA-N 0 3 306.406 4.147 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCCCC[C@H]1C ZINC001617339651 1056817755 /nfs/dbraw/zinc/81/77/55/1056817755.db2.gz ZFGJFOTZDXBFLM-CQSZACIVSA-N 0 3 306.406 4.147 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC=C(c2cccnc2)C1 ZINC000347715158 1057014202 /nfs/dbraw/zinc/01/42/02/1057014202.db2.gz GACHEKSSLCVMDQ-OAHLLOKOSA-N 0 3 323.396 4.149 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2-c1ncc2c(n1)CCNC2 ZINC001241378880 1057031588 /nfs/dbraw/zinc/03/15/88/1057031588.db2.gz MWTJEWKTUZPXGJ-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN CCC[C@H](N[C@H](C)c1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000611299971 1057590480 /nfs/dbraw/zinc/59/04/80/1057590480.db2.gz UGRCVQHPUHWAHH-KDOFPFPSSA-N 0 3 313.401 4.490 20 5 DIBDHN Cc1cc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000611404402 1057597473 /nfs/dbraw/zinc/59/74/73/1057597473.db2.gz GNVQBLSXXNORKM-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001559538975 1059339996 /nfs/dbraw/zinc/33/99/96/1059339996.db2.gz CJKRJADZMKZHMC-CZUORRHYSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001559538973 1059341311 /nfs/dbraw/zinc/34/13/11/1059341311.db2.gz CJKRJADZMKZHMC-BBRMVZONSA-N 0 3 314.360 4.112 20 5 DIBDHN CCCN(CCc1cccs1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001559729841 1059562650 /nfs/dbraw/zinc/56/26/50/1059562650.db2.gz NCDNCAZMBNVCNE-UHFFFAOYSA-N 0 3 322.405 4.250 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@H](C3CCCC3)C2)c1 ZINC001559924761 1059741799 /nfs/dbraw/zinc/74/17/99/1059741799.db2.gz BTQNZBKLFCFHLK-ZDUSSCGKSA-N 0 3 308.809 4.260 20 5 DIBDHN CCOc1cc(CN2CC(C)(C)CCC2(C)C)ccc1[N+](=O)[O-] ZINC001560012327 1059819784 /nfs/dbraw/zinc/81/97/84/1059819784.db2.gz QKYQIDPRWFEWOE-UHFFFAOYSA-N 0 3 320.433 4.394 20 5 DIBDHN CCCCC1(NCc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC001560211908 1059990094 /nfs/dbraw/zinc/99/00/94/1059990094.db2.gz XPZORUVWEXWNRQ-UHFFFAOYSA-N 0 3 306.406 4.194 20 5 DIBDHN C[C@@H](NC/C=C\c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001560587711 1060399403 /nfs/dbraw/zinc/39/94/03/1060399403.db2.gz ZIRDKQZJYSZJRR-HSBHDXMMSA-N 0 3 300.333 4.098 20 5 DIBDHN CC[C@@H]1CCC[C@@H](CN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001560697979 1060548477 /nfs/dbraw/zinc/54/84/77/1060548477.db2.gz WSDHJOFHVAEBDZ-HUUCEWRRSA-N 0 3 302.418 4.169 20 5 DIBDHN CC[C@@H]1CCC[C@H](CN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001560697977 1060551713 /nfs/dbraw/zinc/55/17/13/1060551713.db2.gz WSDHJOFHVAEBDZ-CABCVRRESA-N 0 3 302.418 4.169 20 5 DIBDHN Cc1c(CN2CC([C@H]3CCC[C@H](C)C3)C2)cccc1[N+](=O)[O-] ZINC001560977765 1060842110 /nfs/dbraw/zinc/84/21/10/1060842110.db2.gz JSPLBKBJOZAVBN-ZFWWWQNUSA-N 0 3 302.418 4.161 20 5 DIBDHN CC[C@@H]1[C@@H](C)CCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001473411413 1061146211 /nfs/dbraw/zinc/14/62/11/1061146211.db2.gz ZFFRVFJDWODLMX-XJKSGUPXSA-N 0 3 306.406 4.002 20 5 DIBDHN C[C@@H](N[C@H]1CS[C@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC001462556592 1061257744 /nfs/dbraw/zinc/25/77/44/1061257744.db2.gz MKKVRROJAXHFKK-JMSVASOKSA-N 0 3 308.447 4.166 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN1CCC(CCc2ccccc2)CC1 ZINC001473802742 1061414087 /nfs/dbraw/zinc/41/40/87/1061414087.db2.gz WIYQSVINAJIBIY-UHFFFAOYSA-N 0 3 324.424 4.440 20 5 DIBDHN CCCN(Cc1ccccc1[N+](=O)[O-])[C@H]1C[C@H](OCC)C1(C)C ZINC001459520839 1062180449 /nfs/dbraw/zinc/18/04/49/1062180449.db2.gz ANTCZQLHPWANDT-IRXDYDNUSA-N 0 3 320.433 4.010 20 5 DIBDHN CCCN(Cc1ccccc1[N+](=O)[O-])[C@@H]1C[C@H](OCC)C1(C)C ZINC001459520850 1062180730 /nfs/dbraw/zinc/18/07/30/1062180730.db2.gz ANTCZQLHPWANDT-SJORKVTESA-N 0 3 320.433 4.010 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1Cc2ccccc2[C@H](C)C1 ZINC001474696547 1062423919 /nfs/dbraw/zinc/42/39/19/1062423919.db2.gz LSEGBOXEYXZSJT-CQSZACIVSA-N 0 3 310.397 4.331 20 5 DIBDHN C[C@@H](CSc1ccccc1)N(C)Cc1cccc([N+](=O)[O-])c1 ZINC001460357813 1062804201 /nfs/dbraw/zinc/80/42/01/1062804201.db2.gz DGQIZOCWVAQYAO-AWEZNQCLSA-N 0 3 316.426 4.207 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN1CCCC[C@@H]1CC1CCC1 ZINC001460490121 1062880142 /nfs/dbraw/zinc/88/01/42/1062880142.db2.gz ZBVJXWGCQXPGIK-CQSZACIVSA-N 0 3 306.381 4.279 20 5 DIBDHN Cc1cc(SCCN(C)Cc2ccccc2)c([N+](=O)[O-])s1 ZINC001472771367 1063221283 /nfs/dbraw/zinc/22/12/83/1063221283.db2.gz WMRXWBAVJBAGHG-UHFFFAOYSA-N 0 3 322.455 4.189 20 5 DIBDHN CC[C@@H](C)[C@H]1CCCCN1Cc1cc([N+](=O)[O-])ccc1OC ZINC001473178527 1063486953 /nfs/dbraw/zinc/48/69/53/1063486953.db2.gz HQFFQNODCFESGM-CZUORRHYSA-N 0 3 306.406 4.004 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1Cc2ccccc2C[C@H]1C ZINC001461920345 1063800157 /nfs/dbraw/zinc/80/01/57/1063800157.db2.gz KLNKJXWFMJFXTA-CQSZACIVSA-N 0 3 310.397 4.158 20 5 DIBDHN CC(C)N(CCSC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC001307430581 1065390319 /nfs/dbraw/zinc/39/03/19/1065390319.db2.gz GACVNPOMLHBQQG-UHFFFAOYSA-N 0 3 322.352 4.058 20 5 DIBDHN Cc1ccc([C@@H]2CCN(Cc3ccc([N+](=O)[O-])cc3F)C2)cc1 ZINC001307675237 1065555551 /nfs/dbraw/zinc/55/55/51/1065555551.db2.gz MKTUFDDXCRIFNH-OAHLLOKOSA-N 0 3 314.360 4.032 20 5 DIBDHN Cc1ccc([C@H]2CCN(Cc3ccc([N+](=O)[O-])cc3F)C2)cc1 ZINC001307675235 1065557396 /nfs/dbraw/zinc/55/73/96/1065557396.db2.gz MKTUFDDXCRIFNH-HNNXBMFYSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@H]1CC(C)(C)CC[C@@H]1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC001307704624 1065574807 /nfs/dbraw/zinc/57/48/07/1065574807.db2.gz DKYQOMAVLVENCP-BONVTDFDSA-N 0 3 312.360 4.177 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC2(CCC2)CC1 ZINC001307750244 1065605046 /nfs/dbraw/zinc/60/50/46/1065605046.db2.gz RREVGAZZVJSPQZ-UHFFFAOYSA-N 0 3 318.417 4.148 20 5 DIBDHN CCCCCN(CCCCC)C(=O)c1cccc([N+](=O)[O-])c1 ZINC000005463526 181246284 /nfs/dbraw/zinc/24/62/84/181246284.db2.gz WNRAIOGWIXNDCE-UHFFFAOYSA-N 0 3 306.406 4.417 20 5 DIBDHN CCC[C@H](NCc1sc(C)nc1C)c1cccc([N+](=O)[O-])c1 ZINC000119854740 132137978 /nfs/dbraw/zinc/13/79/78/132137978.db2.gz YYDNCYYLULFPHF-HNNXBMFYSA-N 0 3 319.430 4.299 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H](c2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000537948161 331535484 /nfs/dbraw/zinc/53/54/84/331535484.db2.gz ZUIWDACSCRPKLD-UGSOOPFHSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1c([C@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)cccc1[N+](=O)[O-] ZINC000556921039 331754585 /nfs/dbraw/zinc/75/45/85/331754585.db2.gz LTUWOLNUNIOVNI-OLZOCXBDSA-N 0 3 324.384 4.191 20 5 DIBDHN CC[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000317413543 331773142 /nfs/dbraw/zinc/77/31/42/331773142.db2.gz XUMWCRIGEJHJSA-KRWDZBQOSA-N 0 3 302.349 4.017 20 5 DIBDHN Cc1ccc(CN[C@H](c2cccs2)C2CC2)cc1[N+](=O)[O-] ZINC000518272552 332003917 /nfs/dbraw/zinc/00/39/17/332003917.db2.gz KIMJFZSFRWVWJP-INIZCTEOSA-N 0 3 302.399 4.206 20 5 DIBDHN CCCCCNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000409458154 332034011 /nfs/dbraw/zinc/03/40/11/332034011.db2.gz CVAUPWKBYMOZFT-UHFFFAOYSA-N 0 3 318.373 4.143 20 5 DIBDHN CCN(Cc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccc(F)cc1 ZINC000518474393 332061475 /nfs/dbraw/zinc/06/14/75/332061475.db2.gz LJAPKDVKRHWXME-ZDUSSCGKSA-N 0 3 302.349 4.317 20 5 DIBDHN CS[C@@H](C)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180996908 332172860 /nfs/dbraw/zinc/17/28/60/332172860.db2.gz ISFRQTICVBYSRE-GUYCJALGSA-N 0 3 316.426 4.025 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000111158727 333059524 /nfs/dbraw/zinc/05/95/24/333059524.db2.gz NSPPLQHOKKXIOK-MRXNPFEDSA-N 0 3 302.761 4.025 20 5 DIBDHN CC[C@H](NCCCOc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390570243 333301870 /nfs/dbraw/zinc/30/18/70/333301870.db2.gz OICMLASUBMUKKS-SFHVURJKSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000186757446 333377626 /nfs/dbraw/zinc/37/76/26/333377626.db2.gz SPIJPMRUGKKYGD-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN C[C@@H](CCNCc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000320118961 333426148 /nfs/dbraw/zinc/42/61/48/333426148.db2.gz NLEYZCYRYGVXAJ-ZDUSSCGKSA-N 0 3 302.349 4.017 20 5 DIBDHN COCC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341572577 334453584 /nfs/dbraw/zinc/45/35/84/334453584.db2.gz JWHAQDWFMGGONR-KSSFIOAISA-N 0 3 314.385 4.023 20 5 DIBDHN COCC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341572575 334453670 /nfs/dbraw/zinc/45/36/70/334453670.db2.gz JWHAQDWFMGGONR-KBXCAEBGSA-N 0 3 314.385 4.023 20 5 DIBDHN C[C@H](N[C@@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000051100072 334735826 /nfs/dbraw/zinc/73/58/26/334735826.db2.gz BEDMVXRHUOBZNB-MEDUHNTESA-N 0 3 302.399 4.458 20 5 DIBDHN CCOc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000192543741 336073577 /nfs/dbraw/zinc/07/35/77/336073577.db2.gz HLJTVVZXXCVJIC-KBPBESRZSA-N 0 3 314.385 4.405 20 5 DIBDHN CC[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000352799094 336238226 /nfs/dbraw/zinc/23/82/26/336238226.db2.gz WHHYKZUYJWTPCD-MRXNPFEDSA-N 0 3 302.349 4.017 20 5 DIBDHN CC[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000532485273 336251578 /nfs/dbraw/zinc/25/15/78/336251578.db2.gz HDGDUJWOBWHMIB-KRWDZBQOSA-N 0 3 320.339 4.156 20 5 DIBDHN Cc1c(CN[C@H]2CCCc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000358331459 336624537 /nfs/dbraw/zinc/62/45/37/336624537.db2.gz APHLNCWZJQWDSZ-KRWDZBQOSA-N 0 3 314.360 4.210 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000289281160 337602632 /nfs/dbraw/zinc/60/26/32/337602632.db2.gz QDWWDBAIKRXRPS-GOSISDBHSA-N 0 3 321.380 4.243 20 5 DIBDHN CC1(C)C[C@@H](NCc2cccs2)c2cc([N+](=O)[O-])ccc21 ZINC000433180563 337701696 /nfs/dbraw/zinc/70/16/96/337701696.db2.gz WBDWHICPKHHWEY-OAHLLOKOSA-N 0 3 302.399 4.169 20 5 DIBDHN C[C@H](NCCSc1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000537076380 337885092 /nfs/dbraw/zinc/88/50/92/337885092.db2.gz BTCPUDQBLSNYTJ-LBPRGKRZSA-N 0 3 320.389 4.177 20 5 DIBDHN CC(C)(NCCCc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000429256476 338075124 /nfs/dbraw/zinc/07/51/24/338075124.db2.gz QCFPMYBRHQWPEB-UHFFFAOYSA-N 0 3 316.376 4.191 20 5 DIBDHN Cc1ccc(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000433164537 338183634 /nfs/dbraw/zinc/18/36/34/338183634.db2.gz RNBDCQLUCIMYHF-MRXNPFEDSA-N 0 3 316.426 4.477 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@H]2C[C@H](c3cccc(Cl)c3)C2)cs1 ZINC000435734302 338246771 /nfs/dbraw/zinc/24/67/71/338246771.db2.gz ZAAAPORLJDFFGT-MQMHXKEQSA-N 0 3 322.817 4.346 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000437113342 338301574 /nfs/dbraw/zinc/30/15/74/338301574.db2.gz WRGKMDXPGFNTFQ-ZWNOBZJWSA-N 0 3 304.312 4.222 20 5 DIBDHN CC[C@H](N[C@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000449136970 338596311 /nfs/dbraw/zinc/59/63/11/338596311.db2.gz WQEDJQKCLHEOBP-RISCZKNCSA-N 0 3 319.430 4.032 20 5 DIBDHN CCOc1ccc([C@H](C)NCc2cc(C)cs2)cc1[N+](=O)[O-] ZINC000453318031 338823879 /nfs/dbraw/zinc/82/38/79/338823879.db2.gz MAYGUEYMUYXBRC-LBPRGKRZSA-N 0 3 320.414 4.214 20 5 DIBDHN C[C@H](NC[C@H]1CCC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000467209577 339228329 /nfs/dbraw/zinc/22/83/29/339228329.db2.gz XPCFSGZUNYIVHL-WMLDXEAASA-N 0 3 318.417 4.127 20 5 DIBDHN CSCCCN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000467557121 339242426 /nfs/dbraw/zinc/24/24/26/339242426.db2.gz ZSSZOVLGUPKJAZ-UHFFFAOYSA-N 0 3 320.414 4.040 20 5 DIBDHN Cc1ccc(O[C@H](C)CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000467861606 339247944 /nfs/dbraw/zinc/24/79/44/339247944.db2.gz HTJFHTFIHGXCTC-HUUCEWRRSA-N 0 3 314.385 4.021 20 5 DIBDHN CCS[C@@H]1CCCC[C@H]1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000469794234 339300454 /nfs/dbraw/zinc/30/04/54/339300454.db2.gz OHTVLQQDILGETK-JGGQBBKZSA-N 0 3 308.447 4.310 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@@H](C)c1ccco1 ZINC000470170002 339312591 /nfs/dbraw/zinc/31/25/91/339312591.db2.gz NEDRBTVCFFBPKG-UELRPHRMSA-N 0 3 300.358 4.284 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)CCc1cccs1 ZINC000470171163 339312642 /nfs/dbraw/zinc/31/26/42/339312642.db2.gz GGPXXBLCWLFPJA-KAMYIIQDSA-N 0 3 316.426 4.234 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)Cc1cccs1 ZINC000470171002 339312646 /nfs/dbraw/zinc/31/26/46/339312646.db2.gz DHMOONKZSSUEPK-UKTHLTGXSA-N 0 3 302.399 4.192 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H]1c1ccccc1 ZINC000470172980 339312714 /nfs/dbraw/zinc/31/27/14/339312714.db2.gz GKTJZNGCBASIOQ-LBKOFNPBSA-N 0 3 308.381 4.445 20 5 DIBDHN CC(C)(CF)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000472129321 339363704 /nfs/dbraw/zinc/36/37/04/339363704.db2.gz AJQJNKHZAYOSSO-UHFFFAOYSA-N 0 3 308.378 4.161 20 5 DIBDHN Cc1ccc(SC[C@@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000472131536 339363753 /nfs/dbraw/zinc/36/37/53/339363753.db2.gz AEEWTUXQUHFOHU-CQSZACIVSA-N 0 3 316.426 4.174 20 5 DIBDHN Cc1ccc(SC[C@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000472149584 339364339 /nfs/dbraw/zinc/36/43/39/339364339.db2.gz AASGVENCJZMCOO-AWEZNQCLSA-N 0 3 316.426 4.174 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000475545028 339454551 /nfs/dbraw/zinc/45/45/51/339454551.db2.gz CJTLLVHDTQBOPK-PBHICJAKSA-N 0 3 314.360 4.160 20 5 DIBDHN Cc1c(CN[C@H](C)c2cc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000477745420 339500420 /nfs/dbraw/zinc/50/04/20/339500420.db2.gz VJLUJWUVVVMYTP-GFCCVEGCSA-N 0 3 316.426 4.304 20 5 DIBDHN CC(C)c1ccc(CNC[C@H](C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000479607143 339543566 /nfs/dbraw/zinc/54/35/66/339543566.db2.gz SIGFEIDAZRNPPF-JTQLQIEISA-N 0 3 304.312 4.006 20 5 DIBDHN C[C@@H](N[C@@H](C)CCCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000480159605 339561083 /nfs/dbraw/zinc/56/10/83/339561083.db2.gz MIMNJDQEENLTDD-WDEREUQCSA-N 0 3 304.312 4.367 20 5 DIBDHN Cc1ccc(O[C@@H](C)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000483631052 339670018 /nfs/dbraw/zinc/67/00/18/339670018.db2.gz CJLKDHNXRTUIQP-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN CCC[C@H](NC[C@@H](OC)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000483852029 339676534 /nfs/dbraw/zinc/67/65/34/339676534.db2.gz MCFKDQNSACGIQV-JKSUJKDBSA-N 0 3 308.422 4.087 20 5 DIBDHN CCOc1cc(CN[C@H](C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000492610963 339905182 /nfs/dbraw/zinc/90/51/82/339905182.db2.gz YIYPVOKGRBBWMZ-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN C[C@]1(c2ccccc2)CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000500240360 340053835 /nfs/dbraw/zinc/05/38/35/340053835.db2.gz MXTOFNXEWYWUET-IBGZPJMESA-N 0 3 310.397 4.149 20 5 DIBDHN Cc1ccc(CNCCc2ccc(F)cc2Cl)cc1[N+](=O)[O-] ZINC000500891265 340069331 /nfs/dbraw/zinc/06/93/31/340069331.db2.gz LSZKYZXIFMXJRM-UHFFFAOYSA-N 0 3 322.767 4.028 20 5 DIBDHN C[C@H](NCCSC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000501008839 340072201 /nfs/dbraw/zinc/07/22/01/340072201.db2.gz WMUJMMQFBZJJPI-ZDUSSCGKSA-N 0 3 308.447 4.311 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](c2ccccc2F)C1 ZINC000503655328 340133068 /nfs/dbraw/zinc/13/30/68/340133068.db2.gz RFGIRPXXEKXIBO-UKRRQHHQSA-N 0 3 314.360 4.284 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](c2ccccc2F)C1 ZINC000503655324 340133079 /nfs/dbraw/zinc/13/30/79/340133079.db2.gz RFGIRPXXEKXIBO-DZGCQCFKSA-N 0 3 314.360 4.284 20 5 DIBDHN Cc1ccsc1CN(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000506056095 340184500 /nfs/dbraw/zinc/18/45/00/340184500.db2.gz QENPUUWWJXDNRJ-ALCCZGGFSA-N 0 3 302.399 4.110 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H]1c1ccccc1 ZINC000506267279 340190598 /nfs/dbraw/zinc/19/05/98/340190598.db2.gz GXRDUWLWYBJCDT-SNMSSPIJSA-N 0 3 308.381 4.445 20 5 DIBDHN C[C@H](c1cccs1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000507442261 340219754 /nfs/dbraw/zinc/21/97/54/340219754.db2.gz OBPSXGPPHFHHEV-OQHXTRMZSA-N 0 3 302.399 4.363 20 5 DIBDHN CC(C)N(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000508011879 340237225 /nfs/dbraw/zinc/23/72/25/340237225.db2.gz GTDFTKSMGGSNPD-UHFFFAOYSA-N 0 3 300.358 4.228 20 5 DIBDHN CCS[C@H]1CCCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000303495287 340328143 /nfs/dbraw/zinc/32/81/43/340328143.db2.gz WYSUPLYSTXOGJI-CJNGLKHVSA-N 0 3 308.447 4.263 20 5 DIBDHN Cc1cc2cc(CNC/C=C/c3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000513094309 340393165 /nfs/dbraw/zinc/39/31/65/340393165.db2.gz HKYXUUUFCGOWML-GQCTYLIASA-N 0 3 321.380 4.188 20 5 DIBDHN Cc1c([C@H](C)N[C@H]2c3ccccc3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000537978840 340795111 /nfs/dbraw/zinc/79/51/11/340795111.db2.gz IUQUNHOGFSLFEX-PTAUBWNISA-N 0 3 310.397 4.487 20 5 DIBDHN Cc1ccc([C@@H](C)NC[C@H](C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000539084371 340871760 /nfs/dbraw/zinc/87/17/60/340871760.db2.gz SBGQRTFGTDLJBK-LSDHHAIUSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2c3ccccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000540177987 340920858 /nfs/dbraw/zinc/92/08/58/340920858.db2.gz YLGOOIGBHGVPIL-TYILLQQXSA-N 0 3 310.397 4.487 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(CCCc2ccsc2)C2CC2)cc1 ZINC000543062041 341030035 /nfs/dbraw/zinc/03/00/35/341030035.db2.gz CSLUXZFUMGPCRO-UHFFFAOYSA-N 0 3 316.426 4.254 20 5 DIBDHN CC(C)c1ccc(CNC[C@H]2CCCCS2)cc1[N+](=O)[O-] ZINC000544179149 341073095 /nfs/dbraw/zinc/07/30/95/341073095.db2.gz ZBLKOXVZHDHJPH-CQSZACIVSA-N 0 3 308.447 4.094 20 5 DIBDHN Cc1ccc(CC[C@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000544354610 341077813 /nfs/dbraw/zinc/07/78/13/341077813.db2.gz HXQUEOLNJRKFIR-NSHDSACASA-N 0 3 322.792 4.261 20 5 DIBDHN CC[C@@H](NC[C@@H](OC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000131486631 341091405 /nfs/dbraw/zinc/09/14/05/341091405.db2.gz SOPNCNWFDWPZEN-QZTJIDSGSA-N 0 3 314.385 4.023 20 5 DIBDHN CCc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000545165155 341110981 /nfs/dbraw/zinc/11/09/81/341110981.db2.gz YDRRCBCCMCWQKP-UHFFFAOYSA-N 0 3 304.415 4.244 20 5 DIBDHN CC(C)(NCc1ccnc2ccccc12)c1ccc([N+](=O)[O-])cc1 ZINC000545164803 341110984 /nfs/dbraw/zinc/11/09/84/341110984.db2.gz VWJLGZQRYNGVEV-UHFFFAOYSA-N 0 3 321.380 4.168 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc(Cl)c1 ZINC000132543755 341126830 /nfs/dbraw/zinc/12/68/30/341126830.db2.gz UAGODLQAOYVIHD-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc(Cl)c1 ZINC000132543565 341126856 /nfs/dbraw/zinc/12/68/56/341126856.db2.gz UAGODLQAOYVIHD-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN CC[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000547727109 341229056 /nfs/dbraw/zinc/22/90/56/341229056.db2.gz BVFNVRSAMZPAOV-MRXNPFEDSA-N 0 3 320.339 4.156 20 5 DIBDHN C[C@@H](CN[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000552557521 341398660 /nfs/dbraw/zinc/39/86/60/341398660.db2.gz VBYOABMKWAYFQN-STQMWFEESA-N 0 3 302.349 4.188 20 5 DIBDHN CC(C)N(CCOC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001167186821 1036255320 /nfs/dbraw/zinc/25/53/20/1036255320.db2.gz HWHRQNATQOLBSW-UHFFFAOYSA-N 0 3 320.433 4.155 20 5 DIBDHN CC(C)N(CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC001167216972 1036282683 /nfs/dbraw/zinc/28/26/83/1036282683.db2.gz CSMHDHDJCCZPAU-UHFFFAOYSA-N 0 3 316.376 4.187 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCc2cc(Cl)ccc21 ZINC000598996151 1038214575 /nfs/dbraw/zinc/21/45/75/1038214575.db2.gz LRNTXYKKATWOGR-QGZVFWFLSA-N 0 3 316.788 4.334 20 5 DIBDHN Cc1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C(C)C)s1 ZINC000065162258 1038375096 /nfs/dbraw/zinc/37/50/96/1038375096.db2.gz HSRAYEATKVAJNZ-UHFFFAOYSA-N 0 3 304.415 4.375 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN(Cc1ccccc1)CC1CCC1 ZINC000065161415 1038377728 /nfs/dbraw/zinc/37/77/28/1038377728.db2.gz DSTQXZYDAJPHEM-UHFFFAOYSA-N 0 3 310.397 4.397 20 5 DIBDHN CCC[C@H](C)[C@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859431 1038380982 /nfs/dbraw/zinc/38/09/82/1038380982.db2.gz RSQWFWPHHXXANI-SWLSCSKDSA-N 0 3 317.389 4.137 20 5 DIBDHN CC(C)CC[C@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859389 1038381992 /nfs/dbraw/zinc/38/19/92/1038381992.db2.gz OLFSAFLDXPSKOI-CYBMUJFWSA-N 0 3 317.389 4.137 20 5 DIBDHN Cc1cc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)ccc1F ZINC000451160408 1038595539 /nfs/dbraw/zinc/59/55/39/1038595539.db2.gz GNVQBLSXXNORKM-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN Cc1c(CN[C@@H]2c3cc(F)ccc3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000478510806 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Cc1c([C@H](C)NCc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000152919349 1039461304 /nfs/dbraw/zinc/46/13/04/1039461304.db2.gz FOUQRSWPSNGVBZ-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN CC(C)[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000066236800 1040738486 /nfs/dbraw/zinc/73/84/86/1040738486.db2.gz UHQHZUKUGYTSDY-QGZVFWFLSA-N 0 3 302.349 4.221 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccc(C(F)F)cc1 ZINC000582191543 1040913249 /nfs/dbraw/zinc/91/32/49/1040913249.db2.gz AZCKPXSVFPIIPE-HNNXBMFYSA-N 0 3 318.323 4.310 20 5 DIBDHN Cc1ccc(F)cc1CNC(C)(C)c1ccc([N+](=O)[O-])cc1 ZINC000180282660 1041088318 /nfs/dbraw/zinc/08/83/18/1041088318.db2.gz RFEIJPJHILAGIV-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN CSCCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180575278 1041170100 /nfs/dbraw/zinc/17/01/00/1041170100.db2.gz VOXNQALKKPEGBP-KRWDZBQOSA-N 0 3 316.426 4.027 20 5 DIBDHN CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CCCC1 ZINC000809933002 1041274358 /nfs/dbraw/zinc/27/43/58/1041274358.db2.gz MZXKZJVRRLVRMP-UHFFFAOYSA-N 0 3 303.189 4.276 20 5 DIBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCCC1CC1 ZINC000811480983 1041529361 /nfs/dbraw/zinc/52/93/61/1041529361.db2.gz LKZFBLGJVPNOSR-UHFFFAOYSA-N 0 3 303.189 4.181 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000093116050 1041876885 /nfs/dbraw/zinc/87/68/85/1041876885.db2.gz JYHIHVFTVDCVFT-KRWDZBQOSA-N 0 3 314.360 4.210 20 5 DIBDHN C[C@@H](N[C@@H](c1cccs1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555729 1041963256 /nfs/dbraw/zinc/96/32/56/1041963256.db2.gz GUHYFHPUDGEJCX-QLJPJBMISA-N 0 3 317.414 4.040 20 5 DIBDHN Cc1cc(F)ccc1[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000815566053 1041964156 /nfs/dbraw/zinc/96/41/56/1041964156.db2.gz HPEOIYVHAUVBDP-CHWSQXEVSA-N 0 3 302.349 4.454 20 5 DIBDHN CN(Cc1csc([N+](=O)[O-])c1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC001171019854 1042327779 /nfs/dbraw/zinc/32/77/79/1042327779.db2.gz XRNUWANITMOLBX-HZPDHXFCSA-N 0 3 316.426 4.424 20 5 DIBDHN Cc1c([C@@H](C)NCc2cccc3cccnc32)cccc1[N+](=O)[O-] ZINC000120516433 1042467807 /nfs/dbraw/zinc/46/78/07/1042467807.db2.gz FPDLEMLFZWTCKY-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CCC[C@@H](N[C@@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000231791853 1042627670 /nfs/dbraw/zinc/62/76/70/1042627670.db2.gz SIQFOPBHUVMPJN-GXFFZTMASA-N 0 3 304.312 4.367 20 5 DIBDHN Cc1ccc(CN[C@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000035009652 1042647279 /nfs/dbraw/zinc/64/72/79/1042647279.db2.gz JZVSEUJAYMQKQT-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN CCC[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC001167957968 1042788173 /nfs/dbraw/zinc/78/81/73/1042788173.db2.gz FZDZLUUKGGHTDR-AWEZNQCLSA-N 0 3 306.406 4.006 20 5 DIBDHN Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000519180042 1042936220 /nfs/dbraw/zinc/93/62/20/1042936220.db2.gz GZXWOLHAVHWWSS-ROUUACIJSA-N 0 3 308.381 4.168 20 5 DIBDHN CC[C@@H](N[C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1 ZINC000192895685 1043277320 /nfs/dbraw/zinc/27/73/20/1043277320.db2.gz RUMBAPLYEFHRPS-MSOLQXFVSA-N 0 3 311.385 4.108 20 5 DIBDHN COc1cccc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000268803132 1043333884 /nfs/dbraw/zinc/33/38/84/1043333884.db2.gz QUNVVCBXZKHHLH-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1 ZINC000872276848 1043486964 /nfs/dbraw/zinc/48/69/64/1043486964.db2.gz MYVQFQVLEYIMSS-KBXCAEBGSA-N 0 3 318.417 4.079 20 5 DIBDHN CC[C@H](N[C@H](C)c1ccc2n[nH]cc2c1)c1cccc([N+](=O)[O-])c1 ZINC000353970130 1043667555 /nfs/dbraw/zinc/66/75/55/1043667555.db2.gz BXBFGGQYZCGTRF-PXAZEXFGSA-N 0 3 324.384 4.273 20 5 DIBDHN CCCN(Cc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000561810541 1044007603 /nfs/dbraw/zinc/00/76/03/1044007603.db2.gz KISHGDKJEAJYGL-LJQANCHMSA-N 0 3 310.397 4.494 20 5 DIBDHN CC[C@@H](N[C@@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358377621 1044061840 /nfs/dbraw/zinc/06/18/40/1044061840.db2.gz JJSLTBFJZYEHQT-QZTJIDSGSA-N 0 3 311.385 4.182 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)COC2 ZINC000296230536 1044600331 /nfs/dbraw/zinc/60/03/31/1044600331.db2.gz AHDYGDALZXZVLP-QWHCGFSZSA-N 0 3 312.369 4.037 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](CC(F)(F)F)C1 ZINC000444708412 1044611804 /nfs/dbraw/zinc/61/18/04/1044611804.db2.gz QSCUDNFBSPOHGQ-VXGBXAGGSA-N 0 3 316.323 4.239 20 5 DIBDHN CCOc1ccc([C@H](C)N[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000089553226 1044742264 /nfs/dbraw/zinc/74/22/64/1044742264.db2.gz NYZKCMXDYBMNNI-KGLIPLIRSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1cc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)ccc1F ZINC000447539836 1045143577 /nfs/dbraw/zinc/14/35/77/1045143577.db2.gz HTFZQCSSGVVFNK-SFHVURJKSA-N 0 3 314.360 4.210 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H](c1cccnc1)C1CC1)CCC2 ZINC000447587072 1045155680 /nfs/dbraw/zinc/15/56/80/1045155680.db2.gz OJACXLWKPWIDQY-MOPGFXCFSA-N 0 3 323.396 4.108 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CCCc3ncccc32)cc1[N+](=O)[O-] ZINC000601271832 1045208979 /nfs/dbraw/zinc/20/89/79/1045208979.db2.gz UXBAUTCSUQESPQ-SUMWQHHRSA-N 0 3 311.385 4.026 20 5 DIBDHN C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1Cc1ccccc1[N+](=O)[O-] ZINC000451134264 1045631060 /nfs/dbraw/zinc/63/10/60/1045631060.db2.gz HCQZUMSVYWBUCW-DMDPSCGWSA-N 0 3 316.323 4.146 20 5 DIBDHN Cc1cc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000451165151 1045638290 /nfs/dbraw/zinc/63/82/90/1045638290.db2.gz UJYPLKVHJKUJNN-CHWSQXEVSA-N 0 3 302.349 4.454 20 5 DIBDHN CC(C)[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(F)cc1 ZINC000801521239 1045728842 /nfs/dbraw/zinc/72/88/42/1045728842.db2.gz ZFYDONDYCTWGBL-KRWDZBQOSA-N 0 3 320.339 4.360 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H](c2ccccc2)C2CCC2)cc1F ZINC000801523226 1045731344 /nfs/dbraw/zinc/73/13/44/1045731344.db2.gz LVRVRCIZMNIGED-GOSISDBHSA-N 0 3 314.360 4.365 20 5 DIBDHN CC(C)(NC[C@@]1(C)CC1(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000830009099 1046029868 /nfs/dbraw/zinc/02/98/68/1046029868.db2.gz PVJGRCROEMXPEY-CYBMUJFWSA-N 0 3 317.216 4.003 20 5 DIBDHN C[C@@H](N[C@H](C)c1ccc2c(c1)COC2)c1ccc([N+](=O)[O-])cc1 ZINC000903286501 1046223887 /nfs/dbraw/zinc/22/38/87/1046223887.db2.gz AHDYGDALZXZVLP-CHWSQXEVSA-N 0 3 312.369 4.037 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)COC2)c1ccc([N+](=O)[O-])cc1 ZINC000903286512 1046225339 /nfs/dbraw/zinc/22/53/39/1046225339.db2.gz AHDYGDALZXZVLP-OLZOCXBDSA-N 0 3 312.369 4.037 20 5 DIBDHN O=[N+]([O-])c1cccc(CNC2(c3ccc(F)cc3)CCCC2)c1 ZINC000237744808 1046320659 /nfs/dbraw/zinc/32/06/59/1046320659.db2.gz YPCWPMOGBCAAOD-UHFFFAOYSA-N 0 3 314.360 4.293 20 5 DIBDHN CS[C@@H](CNCc1cc(Cl)ccc1[N+](=O)[O-])C(C)(C)C ZINC000784625492 1046701005 /nfs/dbraw/zinc/70/10/05/1046701005.db2.gz FSZBOLWQKSYRCV-ZDUSSCGKSA-N 0 3 316.854 4.116 20 5 DIBDHN CS[C@H](CNCc1cc(Cl)ccc1[N+](=O)[O-])C(C)(C)C ZINC000784625491 1046701262 /nfs/dbraw/zinc/70/12/62/1046701262.db2.gz FSZBOLWQKSYRCV-CYBMUJFWSA-N 0 3 316.854 4.116 20 5 DIBDHN CS[C@@H](CNCc1cc([N+](=O)[O-])ccc1Cl)C(C)(C)C ZINC000784626440 1046702561 /nfs/dbraw/zinc/70/25/61/1046702561.db2.gz UMWUYLBLLJQPKI-ZDUSSCGKSA-N 0 3 316.854 4.116 20 5 DIBDHN CC(C)(F)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000827189110 1046738653 /nfs/dbraw/zinc/73/86/53/1046738653.db2.gz FKTPIENQWJMFJR-UHFFFAOYSA-N 0 3 309.168 4.129 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(CN[C@H]2C=CCC2)o1 ZINC001203056399 1046843631 /nfs/dbraw/zinc/84/36/31/1046843631.db2.gz XXURDQSLKUZYEK-LBPRGKRZSA-N 0 3 318.760 4.316 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)C1CCCCC1 ZINC000303182553 1046882103 /nfs/dbraw/zinc/88/21/03/1046882103.db2.gz DEOKQTNWCBCBKE-UHFFFAOYSA-N 0 3 306.406 4.147 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)c(CN[C@H]2C[C@H](c3ccccc3)C2)c1 ZINC000797876934 1046900527 /nfs/dbraw/zinc/90/05/27/1046900527.db2.gz IRVXEKBOQDJJDC-CTYIDZIISA-N 0 3 316.788 4.284 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1c2ccccc2C[C@@H]1C ZINC000536873428 1047117246 /nfs/dbraw/zinc/11/72/46/1047117246.db2.gz ZYOUNLPHKSXSAU-NJSLBKSFSA-N 0 3 310.397 4.487 20 5 DIBDHN CC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000539092112 1047736007 /nfs/dbraw/zinc/73/60/07/1047736007.db2.gz XAWAUZZSONQOKY-FZKQIMNGSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1c(CN[C@@H]2CCc3ccc(Cl)cc32)cccc1[N+](=O)[O-] ZINC000478513016 1047793069 /nfs/dbraw/zinc/79/30/69/1047793069.db2.gz HGFVEIYOIMFCQO-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN O=[N+]([O-])c1cccc(CN2CCC(CCc3ccccc3)CC2)c1 ZINC001197837430 1047885645 /nfs/dbraw/zinc/88/56/45/1047885645.db2.gz VRUSHHJYIGWJPJ-UHFFFAOYSA-N 0 3 324.424 4.440 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H]1CCCc2sccc21 ZINC001201880482 1048394135 /nfs/dbraw/zinc/39/41/35/1048394135.db2.gz CYUVLDQNRPQRBG-OAHLLOKOSA-N 0 3 316.426 4.440 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c2ccccc2n1 ZINC001176036040 1048539034 /nfs/dbraw/zinc/53/90/34/1048539034.db2.gz HSAVGUMOOHWINM-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000159543927 1048570478 /nfs/dbraw/zinc/57/04/78/1048570478.db2.gz GAGKLFBKDPIAAC-KPZWWZAWSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1c(Cl)cccc1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC001177328486 1048871686 /nfs/dbraw/zinc/87/16/86/1048871686.db2.gz OZAQXNZCRKZSDG-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN CC(C)[C@@H]1c2ccccc2CCN1Cc1ccccc1[N+](=O)[O-] ZINC001191541979 1048959988 /nfs/dbraw/zinc/95/99/88/1048959988.db2.gz WMZGMRQPHRCULC-LJQANCHMSA-N 0 3 310.397 4.350 20 5 DIBDHN CCC[C@@H](C)N(C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001204890503 1049301431 /nfs/dbraw/zinc/30/14/31/1049301431.db2.gz NYAGRHDGNKHMGN-SNVBAGLBSA-N 0 3 304.312 4.234 20 5 DIBDHN CC(C)[C@H](C)N(C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001180165803 1049305488 /nfs/dbraw/zinc/30/54/88/1049305488.db2.gz JTXQNZZKDKHZBH-VIFPVBQESA-N 0 3 305.205 4.378 20 5 DIBDHN CCCN(CCC)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001205052836 1049356650 /nfs/dbraw/zinc/35/66/50/1049356650.db2.gz MQNXXVZYVXDLSR-UHFFFAOYSA-N 0 3 304.312 4.236 20 5 DIBDHN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCC[C@H](C)C1 ZINC001195179675 1049483751 /nfs/dbraw/zinc/48/37/51/1049483751.db2.gz OHCPSMLATJZGAX-RWMBFGLXSA-N 0 3 317.389 4.040 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](c2cccc(F)c2)C1 ZINC000489854287 1049785367 /nfs/dbraw/zinc/78/53/67/1049785367.db2.gz GJOMGIPMCRXCGZ-ZFWWWQNUSA-N 0 3 314.360 4.284 20 5 DIBDHN Cc1cccc2c1CC[C@H]2N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574583949 1050496433 /nfs/dbraw/zinc/49/64/33/1050496433.db2.gz RTHQUQPEAJGYLN-MSOLQXFVSA-N 0 3 308.381 4.168 20 5 DIBDHN CSc1ccc(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000594505315 1050521549 /nfs/dbraw/zinc/52/15/49/1050521549.db2.gz QJVZZENAIQSXPN-INIZCTEOSA-N 0 3 314.410 4.094 20 5 DIBDHN Cc1ccc2c(c1)[C@H](N[C@H]1CCc3c1cccc3[N+](=O)[O-])CC2 ZINC000594501005 1050521616 /nfs/dbraw/zinc/52/16/16/1050521616.db2.gz CLZVDLJGAAOZFK-ZWKOTPCHSA-N 0 3 308.381 4.168 20 5 DIBDHN Cc1ccc2c(c1)[C@@H](N[C@@H]1CCc3c1cccc3[N+](=O)[O-])CC2 ZINC000594500989 1050521816 /nfs/dbraw/zinc/52/18/16/1050521816.db2.gz CLZVDLJGAAOZFK-MSOLQXFVSA-N 0 3 308.381 4.168 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@]2(CC2(F)F)C1 ZINC000846105061 1050672693 /nfs/dbraw/zinc/67/26/93/1050672693.db2.gz POBGKBOUKSNSOA-WDBUWWRISA-N 0 3 322.355 4.119 20 5 DIBDHN Cc1cccc(C(C)(C)NCc2ccc([N+](=O)[O-])c(F)c2)c1 ZINC000788487516 1050690463 /nfs/dbraw/zinc/69/04/63/1050690463.db2.gz APVZQIZRFVZIJW-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN Cc1cc(C)cc([C@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788596678 1050711440 /nfs/dbraw/zinc/71/14/40/1050711440.db2.gz ZZKQMQZAPHZJFQ-KBPBESRZSA-N 0 3 313.401 4.206 20 5 DIBDHN C[C@H](Cc1cccs1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000036992791 1051106092 /nfs/dbraw/zinc/10/60/92/1051106092.db2.gz NFKHORBEOXKNNE-SNVBAGLBSA-N 0 3 310.806 4.031 20 5 DIBDHN Cc1cccc(C)c1CNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761528163 1051588998 /nfs/dbraw/zinc/58/89/98/1051588998.db2.gz MFZUKESFJNFAKL-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN Cc1ccc(CNCc2ccc(C3CCC3)cc2)cc1[N+](=O)[O-] ZINC000494844248 1052149002 /nfs/dbraw/zinc/14/90/02/1052149002.db2.gz GYNDKVLCHMTEAH-UHFFFAOYSA-N 0 3 310.397 4.461 20 5 DIBDHN C[C@H](c1ccccc1)[C@H](C)NCc1c(F)cccc1[N+](=O)[O-] ZINC000495401936 1052336187 /nfs/dbraw/zinc/33/61/87/1052336187.db2.gz OYAPOYPFDDWDKC-STQMWFEESA-N 0 3 302.349 4.016 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193900930 1052510500 /nfs/dbraw/zinc/51/05/00/1052510500.db2.gz ZHSOPGIUEYCQEK-QWHCGFSZSA-N 0 3 300.358 4.015 20 5 DIBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1 ZINC000064350290 1052977178 /nfs/dbraw/zinc/97/71/78/1052977178.db2.gz OFYWGCUYUKYVQG-UHFFFAOYSA-N 0 3 302.349 4.145 20 5 DIBDHN CN(CCCc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000610132258 1053009280 /nfs/dbraw/zinc/00/92/80/1053009280.db2.gz IXDQVPLSQPVRJL-UHFFFAOYSA-N 0 3 318.804 4.313 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc3c(c1)CCC3)CCC2 ZINC001321282059 1053405213 /nfs/dbraw/zinc/40/52/13/1053405213.db2.gz IMXVYZZTDNOFEA-HXUWFJFHSA-N 0 3 322.408 4.251 20 5 DIBDHN OCC1CN(Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC001231828491 1053884113 /nfs/dbraw/zinc/88/41/13/1053884113.db2.gz ZMBBLTODYGJRDF-UHFFFAOYSA-N 0 3 311.812 4.071 20 5 DIBDHN c1cnc2c(c1)ccc1ccc(CN3CC4(C3)CCCC4)nc12 ZINC001232218831 1053994124 /nfs/dbraw/zinc/99/41/24/1053994124.db2.gz MBARXIDVVPWYCZ-UHFFFAOYSA-N 0 3 303.409 4.159 20 5 DIBDHN CSc1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC001200811796 1053997392 /nfs/dbraw/zinc/99/73/92/1053997392.db2.gz HFJFVEPUTIFWJK-CYBMUJFWSA-N 0 3 316.426 4.476 20 5 DIBDHN CCC(C)(C)OCCNCc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001620960931 1055614874 /nfs/dbraw/zinc/61/48/74/1055614874.db2.gz JNVAEJNMHLCWCY-UHFFFAOYSA-N 0 3 308.422 4.013 20 5 DIBDHN CCN(CC)[C@H](CNc1cc(C)sc1[N+](=O)[O-])c1ccco1 ZINC001611886497 1056204672 /nfs/dbraw/zinc/20/46/72/1056204672.db2.gz OHPRVAWKDCMEGO-CYBMUJFWSA-N 0 3 323.418 4.053 20 5 DIBDHN CC(C)N(CCc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001615297121 1056488962 /nfs/dbraw/zinc/48/89/62/1056488962.db2.gz VUOARBKTJVLHAU-UHFFFAOYSA-N 0 3 316.376 4.187 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@@H]1CCC[C@@H](C)C1 ZINC001615302738 1056489779 /nfs/dbraw/zinc/48/97/79/1056489779.db2.gz JOGUBQJUVNWETD-GDBMZVCRSA-N 0 3 320.433 4.393 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2-c1ncnc2c1CCNC2 ZINC001241378876 1057031305 /nfs/dbraw/zinc/03/13/05/1057031305.db2.gz MSIAIVRSXVXIGY-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@@H]1CCCc2cccnc21 ZINC000922877946 1057072690 /nfs/dbraw/zinc/07/26/90/1057072690.db2.gz CDKMTKWPVIJPQQ-DEQJRXDXSA-N 0 3 323.396 4.060 20 5 DIBDHN Cc1ccc([C@H](C)NCC2=Cc3ccccc3OC2)cc1[N+](=O)[O-] ZINC000175054574 1057380149 /nfs/dbraw/zinc/38/01/49/1057380149.db2.gz FMXCASRLYURUJQ-AWEZNQCLSA-N 0 3 324.380 4.030 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H]1c1ccc(O)cc1 ZINC000611265469 1057587510 /nfs/dbraw/zinc/58/75/10/1057587510.db2.gz SSTWOYIHGTXBGI-VDNIUXDYSA-N 0 3 324.380 4.151 20 5 DIBDHN CC(C)c1ccc(CN2CC[C@@H](c3ccco3)C2)cc1[N+](=O)[O-] ZINC000611271255 1057588675 /nfs/dbraw/zinc/58/86/75/1057588675.db2.gz BSLUZBOTDGADBS-OAHLLOKOSA-N 0 3 314.385 4.301 20 5 DIBDHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001559538974 1059337976 /nfs/dbraw/zinc/33/79/76/1059337976.db2.gz CJKRJADZMKZHMC-CJNGLKHVSA-N 0 3 314.360 4.112 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc3cc[nH]c3c2)cc1[N+](=O)[O-] ZINC001559686803 1059515394 /nfs/dbraw/zinc/51/53/94/1059515394.db2.gz PDKBDRVNKKQSFO-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC2(CCSCC2)CC1 ZINC001560047275 1059862701 /nfs/dbraw/zinc/86/27/01/1059862701.db2.gz BIKLHIBAFVJGHM-CQSZACIVSA-N 0 3 320.458 4.265 20 5 DIBDHN C[C@@H](NC/C=C/c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001560587712 1060399202 /nfs/dbraw/zinc/39/92/02/1060399202.db2.gz ZIRDKQZJYSZJRR-MASHWEEQSA-N 0 3 300.333 4.098 20 5 DIBDHN C=C/C=C\CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001560990220 1060853282 /nfs/dbraw/zinc/85/32/82/1060853282.db2.gz UFIGKSDBHCNRMV-ARJAWSKDSA-N 0 3 301.173 4.124 20 5 DIBDHN C[C@H](Cc1cccs1)N(C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC001473213480 1060983648 /nfs/dbraw/zinc/98/36/48/1060983648.db2.gz KTIFEBBYJWTKNC-LLVKDONJSA-N 0 3 324.833 4.373 20 5 DIBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(C)c(F)c1 ZINC001473339310 1061100277 /nfs/dbraw/zinc/10/02/77/1061100277.db2.gz XTGYIGFGRVRIRY-KRWDZBQOSA-N 0 3 302.349 4.283 20 5 DIBDHN O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNC1CC2(CCC2)C1 ZINC001462401257 1061149970 /nfs/dbraw/zinc/14/99/70/1061149970.db2.gz IBVHZURJAFISLQ-UHFFFAOYSA-N 0 3 314.307 4.036 20 5 DIBDHN CN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCC[C@H]1C(C)(C)C ZINC001473565484 1061254407 /nfs/dbraw/zinc/25/44/07/1061254407.db2.gz TUCNQYMMLJAPBZ-CZUORRHYSA-N 0 3 308.397 4.381 20 5 DIBDHN Cc1c(CN2CCC3(CCSCC3)CC2)cccc1[N+](=O)[O-] ZINC001473694481 1061349175 /nfs/dbraw/zinc/34/91/75/1061349175.db2.gz JHZXGQQGTMHGNR-UHFFFAOYSA-N 0 3 320.458 4.012 20 5 DIBDHN C[C@@H](N(C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1(C)CC1 ZINC001474330479 1061919041 /nfs/dbraw/zinc/91/90/41/1061919041.db2.gz XGASIJTXFAUXQY-SNVBAGLBSA-N 0 3 316.323 4.234 20 5 DIBDHN C[C@H]1CCCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001474451355 1062129864 /nfs/dbraw/zinc/12/98/64/1062129864.db2.gz CLICOZPETCFTLE-NSHDSACASA-N 0 3 316.323 4.236 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1cc(F)ccc1Cl ZINC001254535480 1062163448 /nfs/dbraw/zinc/16/34/48/1062163448.db2.gz KLDQUPBTFWNYBA-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(Cl)cc1F ZINC001254538010 1062165546 /nfs/dbraw/zinc/16/55/46/1062165546.db2.gz MGCOLINXSPXGML-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)c1cc(F)ccc1F ZINC001254543789 1062170638 /nfs/dbraw/zinc/17/06/38/1062170638.db2.gz HCGQKBMBWUQCJP-RYUDHWBXSA-N 0 3 320.339 4.155 20 5 DIBDHN CC1(C)CC(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC001474638156 1062363647 /nfs/dbraw/zinc/36/36/47/1062363647.db2.gz UDOAWDIYUBOFJL-UHFFFAOYSA-N 0 3 303.189 4.180 20 5 DIBDHN CC1(c2ccccc2)CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001459775745 1062389884 /nfs/dbraw/zinc/38/98/84/1062389884.db2.gz WMMMLCHGYTUFQX-UHFFFAOYSA-N 0 3 310.397 4.149 20 5 DIBDHN C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC001459877470 1062465716 /nfs/dbraw/zinc/46/57/16/1062465716.db2.gz MQMLSXCGEKIHCQ-CYBMUJFWSA-N 0 3 316.376 4.190 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2CCCC[C@@H]2C1 ZINC001460111516 1062642175 /nfs/dbraw/zinc/64/21/75/1062642175.db2.gz CDLAYVCGJPQQGT-GASCZTMLSA-N 0 3 318.417 4.004 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cccc3cnccc32)cc1[N+](=O)[O-] ZINC001461254101 1063365517 /nfs/dbraw/zinc/36/55/17/1063365517.db2.gz GLYLCLFSCXMZAT-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cccc3cnccc32)cc1[N+](=O)[O-] ZINC001461254104 1063366205 /nfs/dbraw/zinc/36/62/05/1063366205.db2.gz GLYLCLFSCXMZAT-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CCC(CC)CN(CC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001473103831 1063402388 /nfs/dbraw/zinc/40/23/88/1063402388.db2.gz BDVPWRXYWPPGEU-UHFFFAOYSA-N 0 3 312.385 4.001 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1cccc2ncccc12 ZINC001461736673 1063688266 /nfs/dbraw/zinc/68/82/66/1063688266.db2.gz XCGCKMWGMIDDKK-UHFFFAOYSA-N 0 3 321.380 4.050 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1Cc2ccccc2C[C@@H]1C ZINC001461920342 1063802246 /nfs/dbraw/zinc/80/22/46/1063802246.db2.gz KLNKJXWFMJFXTA-AWEZNQCLSA-N 0 3 310.397 4.158 20 5 DIBDHN CC[C@H]1Cc2ccccc2CN1Cc1cccc([N+](=O)[O-])c1C ZINC001307658499 1065547208 /nfs/dbraw/zinc/54/72/08/1065547208.db2.gz BDOVJFZHORCNKJ-SFHVURJKSA-N 0 3 310.397 4.240 20 5 DIBDHN Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c([O-])c1 ZINC000903286952 1066102434 /nfs/dbraw/zinc/10/24/34/1066102434.db2.gz KDDQXSGDALCHPU-CHWSQXEVSA-N 0 3 300.358 4.021 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC(c2ccco2)CC1 ZINC001308856168 1066335645 /nfs/dbraw/zinc/33/56/45/1066335645.db2.gz WULNDAICNRUNOE-UHFFFAOYSA-N 0 3 314.385 4.184 20 5 DIBDHN CCCCO[C@H]1C[C@H](N[C@@H](C)c2ccccc2[N+](=O)[O-])C1(C)C ZINC001308928869 1066403424 /nfs/dbraw/zinc/40/34/24/1066403424.db2.gz MNYBZKGAZHHRMF-JQFCIGGWSA-N 0 3 320.433 4.229 20 5 DIBDHN O=[N+]([O-])c1cc(CNC2CC2)ccc1Oc1ccccc1Cl ZINC000061003420 184159827 /nfs/dbraw/zinc/15/98/27/184159827.db2.gz JUDNXHUQFLMTCT-UHFFFAOYSA-N 0 3 318.760 4.293 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCc1ccc(F)cc1F ZINC000570875436 332833839 /nfs/dbraw/zinc/83/38/39/332833839.db2.gz XPVJLIQMTFKAKQ-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN Cc1ccc(CN[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000035009941 331465569 /nfs/dbraw/zinc/46/55/69/331465569.db2.gz FAAQDPCTYJXBHE-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN Cc1ccc(CN[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000035009940 331465575 /nfs/dbraw/zinc/46/55/75/331465575.db2.gz FAAQDPCTYJXBHE-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCc3ccccc3)o2)cc1 ZINC000409637092 332043071 /nfs/dbraw/zinc/04/30/71/332043071.db2.gz GGGOYPJNNCRDHJ-UHFFFAOYSA-N 0 3 322.364 4.187 20 5 DIBDHN CCOc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000159391271 332082646 /nfs/dbraw/zinc/08/26/46/332082646.db2.gz HQWXIEQIRVPFJM-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN CC[C@H]1C[C@@H](C)CN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000466934901 333101092 /nfs/dbraw/zinc/10/10/92/333101092.db2.gz GOLVJMSKOVSGDE-HIFRSBDPSA-N 0 3 306.406 4.002 20 5 DIBDHN CC[C@H]1C[C@H](C)CN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000466934903 333101131 /nfs/dbraw/zinc/10/11/31/333101131.db2.gz GOLVJMSKOVSGDE-ZFWWWQNUSA-N 0 3 306.406 4.002 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1cscc1C ZINC000487166965 333115279 /nfs/dbraw/zinc/11/52/79/333115279.db2.gz HIYUHNCSVFYCHD-SDQBBNPISA-N 0 3 302.399 4.158 20 5 DIBDHN C[C@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000040444240 333353135 /nfs/dbraw/zinc/35/31/35/333353135.db2.gz SJTCRXPVSSNXNN-LBPRGKRZSA-N 0 3 304.777 4.142 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000021810534 333390336 /nfs/dbraw/zinc/39/03/36/333390336.db2.gz GTYKUJOCLZTMSQ-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN C[C@H](N[C@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1 ZINC000061328352 333427561 /nfs/dbraw/zinc/42/75/61/333427561.db2.gz CMSRWEXAIILQJN-NHYWBVRUSA-N 0 3 302.399 4.385 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCCOc1ccccc1 ZINC000531690477 333545512 /nfs/dbraw/zinc/54/55/12/333545512.db2.gz GFESZXAMELQJBW-HNNXBMFYSA-N 0 3 314.385 4.023 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000571298277 333715882 /nfs/dbraw/zinc/71/58/82/333715882.db2.gz VAPGORDHVMTAEA-OLZOCXBDSA-N 0 3 316.323 4.149 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H]1CCCc2sccc21 ZINC000341558878 334452270 /nfs/dbraw/zinc/45/22/70/334452270.db2.gz FKBRLMYLBUEVBS-CSPWOOARSA-N 0 3 314.410 4.337 20 5 DIBDHN CC[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000352799093 336238185 /nfs/dbraw/zinc/23/81/85/336238185.db2.gz WHHYKZUYJWTPCD-INIZCTEOSA-N 0 3 302.349 4.017 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCc2c1cccc2F ZINC000532462994 336248885 /nfs/dbraw/zinc/24/88/85/336248885.db2.gz RLWBKGMEIXDGMD-KZULUSFZSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1ccc2nccc(N3CCc4ccc([N+](=O)[O-])cc4C3)c2c1 ZINC000302215779 336354412 /nfs/dbraw/zinc/35/44/12/336354412.db2.gz JBRILBGPMXTKMM-UHFFFAOYSA-N 0 3 319.364 4.014 20 5 DIBDHN CC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000389494205 336396769 /nfs/dbraw/zinc/39/67/69/336396769.db2.gz TXJYFWVCAGAJLU-MRXNPFEDSA-N 0 3 302.349 4.283 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H](c1cccs1)C1CC1 ZINC000571820818 337578149 /nfs/dbraw/zinc/57/81/49/337578149.db2.gz WTUZMRCEVVXYRK-PBHICJAKSA-N 0 3 314.410 4.385 20 5 DIBDHN CCC[C@H](NCc1cc(C)nc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000421866508 337656693 /nfs/dbraw/zinc/65/66/93/337656693.db2.gz BBVXKOUTBACMEY-SFHVURJKSA-N 0 3 313.401 4.238 20 5 DIBDHN C[C@@H](NCc1cc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000536851054 337745348 /nfs/dbraw/zinc/74/53/48/337745348.db2.gz IHGBLQHHTBQIDB-GFCCVEGCSA-N 0 3 316.426 4.386 20 5 DIBDHN C[C@@H]1C[C@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000537246293 337927386 /nfs/dbraw/zinc/92/73/86/337927386.db2.gz HUEYZBHPZHSRRS-MNOVXSKESA-N 0 3 320.776 4.254 20 5 DIBDHN CC(C)c1ccc(CN2CCS[C@@H](C)CC2)cc1[N+](=O)[O-] ZINC000426380802 338029710 /nfs/dbraw/zinc/02/97/10/338029710.db2.gz WWHREBKFYBFTRW-ZDUSSCGKSA-N 0 3 308.447 4.046 20 5 DIBDHN CC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000152800704 338212135 /nfs/dbraw/zinc/21/21/35/338212135.db2.gz MPGHTIQUNCECKW-SCLBCKFNSA-N 0 3 314.385 4.405 20 5 DIBDHN O=[N+]([O-])c1cccc(CN[C@H]2C[C@H](c3cccc(Cl)c3)C2)c1 ZINC000435731009 338246616 /nfs/dbraw/zinc/24/66/16/338246616.db2.gz JGBZIFBRQQYHJF-KOMQPUFPSA-N 0 3 316.788 4.284 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000435733281 338246767 /nfs/dbraw/zinc/24/67/67/338246767.db2.gz SDZFRVWCQZAARZ-KOMQPUFPSA-N 0 3 316.788 4.284 20 5 DIBDHN Cc1c(CN[C@H](c2ccc(F)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000155031062 338253364 /nfs/dbraw/zinc/25/33/64/338253364.db2.gz GSTNZGIDEBOCDH-SFHVURJKSA-N 0 3 314.360 4.283 20 5 DIBDHN Cc1ccc([C@H](C)NCCSc2ccccc2)cc1[N+](=O)[O-] ZINC000195678291 338913998 /nfs/dbraw/zinc/91/39/98/338913998.db2.gz KJOSAOHCUNZJTL-AWEZNQCLSA-N 0 3 316.426 4.346 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H](C)c1ccc(Cl)cc1 ZINC000459774091 339047728 /nfs/dbraw/zinc/04/77/28/339047728.db2.gz VZPSYHHNORAXTR-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000462733361 339085508 /nfs/dbraw/zinc/08/55/08/339085508.db2.gz HVWVOXUGKZEQHD-SQWLQELKSA-N 0 3 318.417 4.052 20 5 DIBDHN C[C@@H](NC[C@@H]1CCC2(CCCCC2)O1)c1ccccc1[N+](=O)[O-] ZINC000467189505 339227546 /nfs/dbraw/zinc/22/75/46/339227546.db2.gz DXQSCENFCKTLGW-CABCVRRESA-N 0 3 318.417 4.127 20 5 DIBDHN C[C@@H](NCCc1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000467838008 339247326 /nfs/dbraw/zinc/24/73/26/339247326.db2.gz DKSGGUCDEULZLR-GFCCVEGCSA-N 0 3 304.777 4.142 20 5 DIBDHN C[C@@H](NCC(C)(C)Oc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000467845821 339247515 /nfs/dbraw/zinc/24/75/15/339247515.db2.gz GYQMVZQQXVOEJF-CQSZACIVSA-N 0 3 314.385 4.103 20 5 DIBDHN CC[C@@H](NCCc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000468000659 339250895 /nfs/dbraw/zinc/25/08/95/339250895.db2.gz QVCGEMORRKKDIO-MRXNPFEDSA-N 0 3 320.339 4.156 20 5 DIBDHN C[C@@H](CCc1ccsc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000468041120 339252458 /nfs/dbraw/zinc/25/24/58/339252458.db2.gz SYBBXKKCNPFTRO-NSHDSACASA-N 0 3 324.833 4.421 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1cc2ccccc2[nH]1 ZINC000468644626 339267874 /nfs/dbraw/zinc/26/78/74/339267874.db2.gz DMHUGVFOQGZBKQ-ZROIWOOFSA-N 0 3 321.380 4.269 20 5 DIBDHN C[C@H](NCCc1cccc([N+](=O)[O-])c1)c1csc(Cl)c1 ZINC000469235344 339283797 /nfs/dbraw/zinc/28/37/97/339283797.db2.gz YKYCVUXMQBJGLX-JTQLQIEISA-N 0 3 310.806 4.203 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]1c1ccc[nH]1 ZINC000470173319 339312734 /nfs/dbraw/zinc/31/27/34/339312734.db2.gz AQSCETHXYDUSFA-BJRSVTDJSA-N 0 3 311.385 4.163 20 5 DIBDHN CCN(Cc1cccc([N+](=O)[O-])c1C)[C@H](C)c1cccc(O)c1 ZINC000471184043 339339867 /nfs/dbraw/zinc/33/98/67/339339867.db2.gz XKJKLIHKQPMBLD-CQSZACIVSA-N 0 3 314.385 4.192 20 5 DIBDHN CC(C)(CF)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000472138898 339364110 /nfs/dbraw/zinc/36/41/10/339364110.db2.gz SVXGRQQBPTZSAX-UHFFFAOYSA-N 0 3 308.378 4.161 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000475328479 339446633 /nfs/dbraw/zinc/44/66/33/339446633.db2.gz BUODRHRIDSJGRI-WMLDXEAASA-N 0 3 314.360 4.160 20 5 DIBDHN Cc1c(CN[C@@H](C)c2cc3c(s2)CCC3)cccc1[N+](=O)[O-] ZINC000477745424 339500371 /nfs/dbraw/zinc/50/03/71/339500371.db2.gz VJLUJWUVVVMYTP-LBPRGKRZSA-N 0 3 316.426 4.304 20 5 DIBDHN CC[C@H](N[C@@H]1CCCO[C@@H]1CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000480753220 339585979 /nfs/dbraw/zinc/58/59/79/339585979.db2.gz AXYODICJGGXIJG-RCCFBDPRSA-N 0 3 320.433 4.229 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CC[C@@H](c2ccccc2F)C1 ZINC000481837737 339615111 /nfs/dbraw/zinc/61/51/11/339615111.db2.gz PVFBARGCAYPVDG-UKRRQHHQSA-N 0 3 314.360 4.160 20 5 DIBDHN Cc1ccc(OCCCN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000482048680 339621044 /nfs/dbraw/zinc/62/10/44/339621044.db2.gz XUQOMFRDQZYMQN-OAHLLOKOSA-N 0 3 314.385 4.023 20 5 DIBDHN C[C@@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)Sc1ccccc1 ZINC000483619883 339669656 /nfs/dbraw/zinc/66/96/56/339669656.db2.gz HFUAXVPQSLFUHO-KBPBESRZSA-N 0 3 316.426 4.426 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](N[C@H]2CC=CCC2)c2ccccc2)c1 ZINC000494039523 339939587 /nfs/dbraw/zinc/93/95/87/339939587.db2.gz PHYJACDVUSSVRG-PKOBYXMFSA-N 0 3 308.381 4.383 20 5 DIBDHN CC[C@H]1C[C@@]1(NCc1cccc([N+](=O)[O-])c1)c1cccc(C)c1 ZINC000500537666 340061789 /nfs/dbraw/zinc/06/17/89/340061789.db2.gz UKRVGPXTBLZSSK-LPHOPBHVSA-N 0 3 310.397 4.318 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](c2ccccc2F)C1 ZINC000503655330 340133044 /nfs/dbraw/zinc/13/30/44/340133044.db2.gz RFGIRPXXEKXIBO-ZFWWWQNUSA-N 0 3 314.360 4.284 20 5 DIBDHN CC[C@@H](c1cccc(OC)c1)N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000516598641 340171248 /nfs/dbraw/zinc/17/12/48/340171248.db2.gz BYISSAKWRAILSS-SFHVURJKSA-N 0 3 314.385 4.187 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H]1c1ccccc1 ZINC000506267276 340190491 /nfs/dbraw/zinc/19/04/91/340190491.db2.gz GXRDUWLWYBJCDT-HJLMUGLJSA-N 0 3 308.381 4.445 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H](c2ccccc2)C1 ZINC000507079432 340206744 /nfs/dbraw/zinc/20/67/44/340206744.db2.gz XCJOAYPAKGRYTN-WGLAMXGCSA-N 0 3 308.381 4.098 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H](c2ccccc2)C1 ZINC000507079429 340206750 /nfs/dbraw/zinc/20/67/50/340206750.db2.gz XCJOAYPAKGRYTN-OEPRFQHASA-N 0 3 308.381 4.098 20 5 DIBDHN C[C@H](c1ccccc1)[C@H](C)NCc1c(F)cc([N+](=O)[O-])cc1F ZINC000509009152 340258027 /nfs/dbraw/zinc/25/80/27/340258027.db2.gz XTXKYGKBSAOLAQ-RYUDHWBXSA-N 0 3 320.339 4.155 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(Cc2ccc(F)cc2)CC2CC2)cc1 ZINC000302951320 340289621 /nfs/dbraw/zinc/28/96/21/340289621.db2.gz DTVHFFQIJAZCEE-UHFFFAOYSA-N 0 3 314.360 4.146 20 5 DIBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1cccc(C(F)F)c1 ZINC000511126819 340321764 /nfs/dbraw/zinc/32/17/64/340321764.db2.gz QTFDPMPSJHDPPW-UHFFFAOYSA-N 0 3 320.339 4.207 20 5 DIBDHN CCS[C@H]1CCCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000303495286 340328183 /nfs/dbraw/zinc/32/81/83/340328183.db2.gz WYSUPLYSTXOGJI-BBRMVZONSA-N 0 3 308.447 4.263 20 5 DIBDHN CCS[C@@H]1CCCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000303495288 340328249 /nfs/dbraw/zinc/32/82/49/340328249.db2.gz WYSUPLYSTXOGJI-CZUORRHYSA-N 0 3 308.447 4.263 20 5 DIBDHN C[C@@H](NC/C=C\c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000512101957 340348546 /nfs/dbraw/zinc/34/85/46/340348546.db2.gz WQECZTCQOLNFDN-VSQXVHSFSA-N 0 3 318.323 4.237 20 5 DIBDHN CSCc1ccc(CNCc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000512978251 340386533 /nfs/dbraw/zinc/38/65/33/340386533.db2.gz ZUOHFSZXFUGQPW-UHFFFAOYSA-N 0 3 316.426 4.056 20 5 DIBDHN CCC[C@H](N[C@@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000231791857 340626148 /nfs/dbraw/zinc/62/61/48/340626148.db2.gz SIQFOPBHUVMPJN-GWCFXTLKSA-N 0 3 304.312 4.367 20 5 DIBDHN C[C@H](NCCc1cccc([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000537950824 340792931 /nfs/dbraw/zinc/79/29/31/340792931.db2.gz NWJGEOGBBDGGCK-ZDUSSCGKSA-N 0 3 310.353 4.234 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000537990685 340806053 /nfs/dbraw/zinc/80/60/53/340806053.db2.gz JYDPGIZEDQEZSE-INIZCTEOSA-N 0 3 302.761 4.025 20 5 DIBDHN Cc1cc([C@H](C)NCCOc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000542529400 341012348 /nfs/dbraw/zinc/01/23/48/341012348.db2.gz BNHOWDGPOOLRHA-LBPRGKRZSA-N 0 3 320.414 4.003 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000544833561 341095566 /nfs/dbraw/zinc/09/55/66/341095566.db2.gz 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Cc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1F ZINC000119086314 1037111496 /nfs/dbraw/zinc/11/14/96/1037111496.db2.gz HJDRMEYNCUCFIB-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN Cc1c(CN2CCC[C@@H]2c2cccs2)cccc1[N+](=O)[O-] ZINC000051230725 1038002886 /nfs/dbraw/zinc/00/28/86/1038002886.db2.gz SCRANTIOZRXECJ-OAHLLOKOSA-N 0 3 302.399 4.302 20 5 DIBDHN Cc1ccc(CNCc2csc3ccccc23)cc1[N+](=O)[O-] ZINC000061047906 1038182848 /nfs/dbraw/zinc/18/28/48/1038182848.db2.gz VRBSCPVTBQUFGA-UHFFFAOYSA-N 0 3 312.394 4.408 20 5 DIBDHN Cc1c(CN2CCC(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000603841137 1038294719 /nfs/dbraw/zinc/29/47/19/1038294719.db2.gz ZEKCWDZIKTVQCR-UHFFFAOYSA-N 0 3 310.397 4.283 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CCC(F)(F)C2)o1 ZINC000610787843 1038308877 /nfs/dbraw/zinc/30/88/77/1038308877.db2.gz YUJBACICBBKSSJ-LLVKDONJSA-N 0 3 322.311 4.132 20 5 DIBDHN Cc1cc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000610804638 1038350566 /nfs/dbraw/zinc/35/05/66/1038350566.db2.gz SFBREESZSUGIQY-STQMWFEESA-N 0 3 302.349 4.454 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000610806630 1038352179 /nfs/dbraw/zinc/35/21/79/1038352179.db2.gz WWVQPNPSIVQUGZ-CYBMUJFWSA-N 0 3 309.369 4.235 20 5 DIBDHN CC(C)[C@H]1c2ccccc2CCN1Cc1cccc([N+](=O)[O-])c1 ZINC001167656267 1039168245 /nfs/dbraw/zinc/16/82/45/1039168245.db2.gz HQUGKRFIESSRJB-IBGZPJMESA-N 0 3 310.397 4.350 20 5 DIBDHN CCN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCC1 ZINC000089886041 1039279705 /nfs/dbraw/zinc/27/97/05/1039279705.db2.gz TYRFDLAKVMHBEG-UHFFFAOYSA-N 0 3 315.373 4.014 20 5 DIBDHN C[C@H](NCc1cc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000540167014 1039434332 /nfs/dbraw/zinc/43/43/32/1039434332.db2.gz XDIBSYFPLJRXOI-LBPRGKRZSA-N 0 3 316.426 4.386 20 5 DIBDHN CCC[C@]1(C)CCCN(Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000464833439 1039765081 /nfs/dbraw/zinc/76/50/81/1039765081.db2.gz DTQFXFCIOHURTA-QGZVFWFLSA-N 0 3 306.406 4.006 20 5 DIBDHN CC(C)[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000066236798 1040737540 /nfs/dbraw/zinc/73/75/40/1040737540.db2.gz NUZNKHZJEWDLRR-KRWDZBQOSA-N 0 3 302.349 4.221 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000414062315 1040804636 /nfs/dbraw/zinc/80/46/36/1040804636.db2.gz CMSPEZUZIGWWQJ-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1cccc([C@H](C)NCc2ccc([N+](=O)[O-])c(F)c2)c1C ZINC000276258208 1041102520 /nfs/dbraw/zinc/10/25/20/1041102520.db2.gz APMMNRQIAQVVOE-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN CCC[C@@H](NCc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120134749 1041185047 /nfs/dbraw/zinc/18/50/47/1041185047.db2.gz SMRPODBWIXJTOC-GOSISDBHSA-N 0 3 314.385 4.234 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000122293314 1041387682 /nfs/dbraw/zinc/38/76/82/1041387682.db2.gz ISLGBNIXDUKGCZ-KRWDZBQOSA-N 0 3 314.360 4.210 20 5 DIBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CC12CCCC2 ZINC000811495413 1041524245 /nfs/dbraw/zinc/52/42/45/1041524245.db2.gz DDNCDVFOXCTMJT-GFCCVEGCSA-N 0 3 315.200 4.324 20 5 DIBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CC12CCCC2 ZINC000811495414 1041524597 /nfs/dbraw/zinc/52/45/97/1041524597.db2.gz DDNCDVFOXCTMJT-LBPRGKRZSA-N 0 3 315.200 4.324 20 5 DIBDHN C[C@H]1CC(C)(C)CC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000481086851 1041526590 /nfs/dbraw/zinc/52/65/90/1041526590.db2.gz CWLFOZCTYVZWHX-WCQYABFASA-N 0 3 317.389 4.040 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC[C@H](c3ccccc3)C2)cc1F ZINC000814642622 1041847298 /nfs/dbraw/zinc/84/72/98/1041847298.db2.gz JRMQIEVYAVOZPU-INIZCTEOSA-N 0 3 314.360 4.114 20 5 DIBDHN C[C@H](N[C@@H](c1cccs1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555727 1041962928 /nfs/dbraw/zinc/96/29/28/1041962928.db2.gz GUHYFHPUDGEJCX-MGPLVRAMSA-N 0 3 317.414 4.040 20 5 DIBDHN CC(C)(NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000067011190 1042141204 /nfs/dbraw/zinc/14/12/04/1042141204.db2.gz YOWHVEAEPICLMT-UHFFFAOYSA-N 0 3 304.777 4.273 20 5 DIBDHN CCOc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000391094407 1042181736 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CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)CC(F)(F)F ZINC000872064266 1043446066 /nfs/dbraw/zinc/44/60/66/1043446066.db2.gz XPQDEHFBHWGLNR-BDAKNGLRSA-N 0 3 322.352 4.308 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](OC2CCC2)CC1 ZINC000872278762 1043490909 /nfs/dbraw/zinc/49/09/09/1043490909.db2.gz ZXVMWMRDZVAPBG-HOCLYGCPSA-N 0 3 318.417 4.079 20 5 DIBDHN COc1cccc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000267470469 1043578790 /nfs/dbraw/zinc/57/87/90/1043578790.db2.gz XQDJCTVAWKVYED-OLZOCXBDSA-N 0 3 300.358 4.015 20 5 DIBDHN CCCN(Cc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000561810538 1044007900 /nfs/dbraw/zinc/00/79/00/1044007900.db2.gz KISHGDKJEAJYGL-IBGZPJMESA-N 0 3 310.397 4.494 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NC1(c2ccccc2)CCC1 ZINC000566019761 1044468862 /nfs/dbraw/zinc/46/88/62/1044468862.db2.gz RMJAXALALZYKDB-QGZVFWFLSA-N 0 3 308.381 4.251 20 5 DIBDHN CC(C)(NCc1coc2ccccc12)c1ccc([N+](=O)[O-])cc1 ZINC000121682448 1045050259 /nfs/dbraw/zinc/05/02/59/1045050259.db2.gz NWHJXAHFRIYWGI-UHFFFAOYSA-N 0 3 310.353 4.366 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1(c3ccccc3)CC1)CCC2 ZINC000447589504 1045155125 /nfs/dbraw/zinc/15/51/25/1045155125.db2.gz XYQZLBCVDICPEH-SFHVURJKSA-N 0 3 308.381 4.251 20 5 DIBDHN CC[C@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])c(C)c1)c1ccco1 ZINC000557696748 1045218728 /nfs/dbraw/zinc/21/87/28/1045218728.db2.gz WCKXEDUSKXHZCI-ZFWWWQNUSA-N 0 3 317.389 4.038 20 5 DIBDHN CCc1cnccc1[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000579270050 1045303062 /nfs/dbraw/zinc/30/30/62/1045303062.db2.gz MNHQMGFDULUJIG-UONOGXRCSA-N 0 3 313.401 4.272 20 5 DIBDHN C[C@H]1[C@H](c2ccccc2)CCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000751500027 1045607208 /nfs/dbraw/zinc/60/72/08/1045607208.db2.gz NGZZCUHUSWXKAX-SUMWQHHRSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1Cc1ccccc1[N+](=O)[O-] ZINC000451134265 1045631357 /nfs/dbraw/zinc/63/13/57/1045631357.db2.gz HCQZUMSVYWBUCW-LOWVWBTDSA-N 0 3 316.323 4.146 20 5 DIBDHN CN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCCc2ccccc21 ZINC000801508982 1045725079 /nfs/dbraw/zinc/72/50/79/1045725079.db2.gz KLTCNBCHKXLILS-KRWDZBQOSA-N 0 3 314.360 4.243 20 5 DIBDHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801517291 1045729325 /nfs/dbraw/zinc/72/93/25/1045729325.db2.gz LZBNLSIIUCXQDH-CJNGLKHVSA-N 0 3 314.360 4.112 20 5 DIBDHN CCc1ccc(C(C)(C)NCc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000801530771 1045733778 /nfs/dbraw/zinc/73/37/78/1045733778.db2.gz GKORIQHWQILYSE-UHFFFAOYSA-N 0 3 316.376 4.321 20 5 DIBDHN C[C@H](NCC1C[C@H]2CC[C@@H](C1)S2)c1c(F)cccc1[N+](=O)[O-] ZINC000903157150 1046178693 /nfs/dbraw/zinc/17/86/93/1046178693.db2.gz ZBBBOSRZBQHCEP-WODVXLOZSA-N 0 3 324.421 4.059 20 5 DIBDHN C[C@@H](NC[C@@H](C)c1ccccc1[N+](=O)[O-])c1ccncc1Cl ZINC000903246214 1046208211 /nfs/dbraw/zinc/20/82/11/1046208211.db2.gz SGNHPNMZQSJWAL-VXGBXAGGSA-N 0 3 319.792 4.098 20 5 DIBDHN C[C@@H](N[C@@H]1CCSC(C)(C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000903280028 1046220232 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O=[N+]([O-])c1ccc(Cl)c(CNC2CC(c3ccccc3)C2)c1 ZINC000798503361 1046958937 /nfs/dbraw/zinc/95/89/37/1046958937.db2.gz IRVXEKBOQDJJDC-UHFFFAOYSA-N 0 3 316.788 4.284 20 5 DIBDHN Cc1cc([C@@H](C)NC/C=C\c2ccccc2[N+](=O)[O-])c(C)o1 ZINC001116474639 1047146442 /nfs/dbraw/zinc/14/64/42/1047146442.db2.gz HCNVNUMLUGMAEL-FWPCIQOSSA-N 0 3 300.358 4.169 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1F ZINC000119404829 1047452516 /nfs/dbraw/zinc/45/25/16/1047452516.db2.gz MFIOCWYDUSEPPA-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN CC[C@H]1CC[C@H](C)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000537853146 1047642181 /nfs/dbraw/zinc/64/21/81/1047642181.db2.gz WFYGAMCVUOUOOJ-WFASDCNBSA-N 0 3 315.373 4.013 20 5 DIBDHN CCc1cnccc1[C@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000538113253 1047658479 /nfs/dbraw/zinc/65/84/79/1047658479.db2.gz BRYGBKFWLFEDOQ-KBPBESRZSA-N 0 3 313.401 4.272 20 5 DIBDHN CC(C)c1ccc(CNC[C@@H](C)C(F)(F)F)cc1[N+](=O)[O-] ZINC000479607144 1047939771 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O=[N+]([O-])c1ccc(CN2CC[C@H](c3ccccc3)C2)cc1Cl ZINC000761506865 1051582958 /nfs/dbraw/zinc/58/29/58/1051582958.db2.gz OEPMPNMWVPIIHJ-HNNXBMFYSA-N 0 3 316.788 4.238 20 5 DIBDHN Cc1cc2cc3cc(C)c(Nc4cnn(C)c4)cc3nc2cc1N ZINC001174332255 1052103479 /nfs/dbraw/zinc/10/34/79/1052103479.db2.gz MXNMEWOSOKYNLV-UHFFFAOYSA-N 0 3 317.396 4.064 20 5 DIBDHN CCCNc1ccc(CNCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000193156716 1052214265 /nfs/dbraw/zinc/21/42/65/1052214265.db2.gz ZVCIMTLRFWXPRP-UHFFFAOYSA-N 0 3 313.401 4.015 20 5 DIBDHN CC[C@H](NCc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000112017882 1052638367 /nfs/dbraw/zinc/63/83/67/1052638367.db2.gz NTGJLVAABFJXKI-HNNXBMFYSA-N 0 3 304.777 4.489 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](c2cccc(F)c2)C1 ZINC000489854282 1052975316 /nfs/dbraw/zinc/97/53/16/1052975316.db2.gz GJOMGIPMCRXCGZ-DZGCQCFKSA-N 0 3 314.360 4.284 20 5 DIBDHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609672582 1052986578 /nfs/dbraw/zinc/98/65/78/1052986578.db2.gz 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CC[C@@H]1CC[C@H](C)N(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001617918879 1056901468 /nfs/dbraw/zinc/90/14/68/1056901468.db2.gz UAVBAZVIYTYAKF-LSDHHAIUSA-N 0 3 320.433 4.393 20 5 DIBDHN CCOc1cc(CN2CCC3(CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001618122125 1056925975 /nfs/dbraw/zinc/92/59/75/1056925975.db2.gz HSKWEPQRWGHNMZ-UHFFFAOYSA-N 0 3 318.417 4.150 20 5 DIBDHN CO[C@@H](CNC(C)(C)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC001618196465 1056933206 /nfs/dbraw/zinc/93/32/06/1056933206.db2.gz NNYCFJUQIUSOGW-KRWDZBQOSA-N 0 3 320.433 4.015 20 5 DIBDHN Cc1c(CN[C@@H](C)c2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC000391101014 1057054350 /nfs/dbraw/zinc/05/43/50/1057054350.db2.gz PLTLPKKEQXAEKH-AWEZNQCLSA-N 0 3 310.397 4.243 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN[C@H]1CCCc2cccnc21 ZINC000922880449 1057073350 /nfs/dbraw/zinc/07/33/50/1057073350.db2.gz CDKMTKWPVIJPQQ-BJRSVTDJSA-N 0 3 323.396 4.060 20 5 DIBDHN CC(C)c1ccc(CN2CC[C@H](c3ccco3)C2)cc1[N+](=O)[O-] ZINC000611271254 1057587258 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/nfs/dbraw/zinc/46/95/18/1063469518.db2.gz ALQJYPOLOWLYMP-OAHLLOKOSA-N 0 3 320.433 4.252 20 5 DIBDHN CCN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC(C)C ZINC001461977943 1063854083 /nfs/dbraw/zinc/85/40/83/1063854083.db2.gz VXVUWXUDTOWKRY-UHFFFAOYSA-N 0 3 305.205 4.380 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)Cc1cccc(F)c1 ZINC001462031286 1063891578 /nfs/dbraw/zinc/89/15/78/1063891578.db2.gz NVTCFDUOVJVPQP-NTEUORMPSA-N 0 3 314.360 4.269 20 5 DIBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(CCCC(F)(F)F)C2)cc1 ZINC001262366626 1063965425 /nfs/dbraw/zinc/96/54/25/1063965425.db2.gz OUSBGNOYZGHROQ-ZDUSSCGKSA-N 0 3 316.323 4.117 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1[C@@H](C)CCC1(C)C ZINC001307834561 1065645503 /nfs/dbraw/zinc/64/55/03/1065645503.db2.gz MCSJXRLXMREQPT-ZDUSSCGKSA-N 0 3 306.406 4.145 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCCC3(CCCC3)CC2)cc1F ZINC001307923026 1065684948 /nfs/dbraw/zinc/68/49/48/1065684948.db2.gz FTCMFUQYMSTPBV-UHFFFAOYSA-N 0 3 306.381 4.280 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cncc3ccccc32)cc1[N+](=O)[O-] ZINC001308291548 1065888400 /nfs/dbraw/zinc/88/84/00/1065888400.db2.gz VFYOBDQGAUOSLG-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cncc3ccccc32)cc1[N+](=O)[O-] ZINC001308291549 1065889034 /nfs/dbraw/zinc/88/90/34/1065889034.db2.gz VFYOBDQGAUOSLG-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CC(C)(F)CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC001308484857 1066022121 /nfs/dbraw/zinc/02/21/21/1066022121.db2.gz GVAIOCJWXMYASK-UHFFFAOYSA-N 0 3 308.378 4.161 20 5 DIBDHN CN(Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC(C)(C)C ZINC001308579231 1066094802 /nfs/dbraw/zinc/09/48/02/1066094802.db2.gz ZAALYUAKPKKCQS-UHFFFAOYSA-N 0 3 304.312 4.092 20 5 DIBDHN CC(C)(NCc1cccc2c1CCC2)c1ccc([N+](=O)[O-])cc1 ZINC001308671676 1066147949 /nfs/dbraw/zinc/14/79/49/1066147949.db2.gz JASCIRATKWAYLU-UHFFFAOYSA-N 0 3 310.397 4.108 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CC([C@H]2CCC[C@H](C)C2)C1 ZINC001308911065 1066389687 /nfs/dbraw/zinc/38/96/87/1066389687.db2.gz DAEVDCFIUFAKJI-BBRMVZONSA-N 0 3 316.445 4.470 20 5 DIBDHN CCCCO[C@H]1C[C@@H](N[C@@H](C)c2ccccc2[N+](=O)[O-])C1(C)C ZINC001308928871 1066403455 /nfs/dbraw/zinc/40/34/55/1066403455.db2.gz MNYBZKGAZHHRMF-XKQJLSEDSA-N 0 3 320.433 4.229 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCc3sccc32)cc1[N+](=O)[O-] ZINC000061360084 184168846 /nfs/dbraw/zinc/16/88/46/184168846.db2.gz LAYKIBYXGOBANN-AWEZNQCLSA-N 0 3 302.399 4.132 20 5 DIBDHN Cc1c([C@@H](C)NC[C@@H](C)Oc2ccccc2)cccc1[N+](=O)[O-] ZINC000537981333 332932947 /nfs/dbraw/zinc/93/29/47/332932947.db2.gz GXWYQEDNWUVDDH-UKRRQHHQSA-N 0 3 314.385 4.021 20 5 DIBDHN CCN(Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000518474193 332061267 /nfs/dbraw/zinc/06/12/67/332061267.db2.gz XVESNGJAJAGQMU-AWEZNQCLSA-N 0 3 314.385 4.187 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CNCCC3(F)CCC3)o2)cc1 ZINC000561758274 332492448 /nfs/dbraw/zinc/49/24/48/332492448.db2.gz XFZYSXLASXWCFA-UHFFFAOYSA-N 0 3 318.348 4.227 20 5 DIBDHN CC[C@H](NCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000053148081 332961810 /nfs/dbraw/zinc/96/18/10/332961810.db2.gz KKWZGBIBUKOXDW-INIZCTEOSA-N 0 3 304.777 4.489 20 5 DIBDHN Cc1ccc(C[C@H]2CCCN2Cc2csc([N+](=O)[O-])c2)cc1 ZINC000500210933 333232026 /nfs/dbraw/zinc/23/20/26/333232026.db2.gz SMBRCFPFCLEUHF-MRXNPFEDSA-N 0 3 316.426 4.172 20 5 DIBDHN Cc1c(CN[C@@H]2CCCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000323536936 333375117 /nfs/dbraw/zinc/37/51/17/333375117.db2.gz YVAKSZORIZQENJ-GOSISDBHSA-N 0 3 310.397 4.461 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H]1c1ccccn1 ZINC000526063104 333384296 /nfs/dbraw/zinc/38/42/96/333384296.db2.gz WHGHYGDXZHBNPF-LBKOFNPBSA-N 0 3 323.396 4.230 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000021810536 333390268 /nfs/dbraw/zinc/39/02/68/333390268.db2.gz GTYKUJOCLZTMSQ-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000414119551 333906507 /nfs/dbraw/zinc/90/65/07/333906507.db2.gz DDYIXTLUVNSQPO-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H](c1ccccc1)C1CC1 ZINC000571656026 334074950 /nfs/dbraw/zinc/07/49/50/334074950.db2.gz YMDWLYFYAJEJTH-HKUYNNGSSA-N 0 3 308.381 4.323 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC1CCCC1 ZINC000303298086 334306642 /nfs/dbraw/zinc/30/66/42/334306642.db2.gz YGPCSWPMIYCTMJ-UHFFFAOYSA-N 0 3 306.406 4.004 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@H]1CCCc2sccc21 ZINC000341558891 334452227 /nfs/dbraw/zinc/45/22/27/334452227.db2.gz FKBRLMYLBUEVBS-VOKGJARPSA-N 0 3 314.410 4.337 20 5 DIBDHN O=[N+]([O-])c1cccc([C@@H](NC[C@H]2CC23CC3)c2ccccc2)c1 ZINC000417330096 334709252 /nfs/dbraw/zinc/70/92/52/334709252.db2.gz AGENACRAQYGWAE-AEFFLSMTSA-N 0 3 308.381 4.074 20 5 DIBDHN Cc1cc([C@H](NCc2cccc([N+](=O)[O-])c2)C2CC2)ccc1F ZINC000535369348 334721418 /nfs/dbraw/zinc/72/14/18/334721418.db2.gz SIPXPPHBWSSIEN-GOSISDBHSA-N 0 3 314.360 4.283 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCc2c1cccc2F ZINC000532462996 336248861 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O=[N+]([O-])c1cc(CN[C@H]2CC[C@@H](Cc3ccccc3)C2)cs1 ZINC000438355202 338340990 /nfs/dbraw/zinc/34/09/90/338340990.db2.gz RSGIHGFDIMIMFG-HOCLYGCPSA-N 0 3 316.426 4.157 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCC(CF)CC3)o2)cc1 ZINC000449454792 338626079 /nfs/dbraw/zinc/62/60/79/338626079.db2.gz KBWUSBCNVCJUAW-UHFFFAOYSA-N 0 3 318.348 4.036 20 5 DIBDHN C[C@@H]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)c2sccc21 ZINC000453138551 338798602 /nfs/dbraw/zinc/79/86/02/338798602.db2.gz AOQHHXCCZFQMCN-IAQYHMDHSA-N 0 3 302.399 4.385 20 5 DIBDHN C[C@H](N[C@H]1CCCc2c(F)cccc21)c1cccc([N+](=O)[O-])c1 ZINC000453232010 338811552 /nfs/dbraw/zinc/81/15/52/338811552.db2.gz IYBNGLBWXWPXRP-SGTLLEGYSA-N 0 3 314.360 4.462 20 5 DIBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000462733358 339085452 /nfs/dbraw/zinc/08/54/52/339085452.db2.gz HVWVOXUGKZEQHD-IIAWOOMASA-N 0 3 318.417 4.052 20 5 DIBDHN CCS[C@@H]1CC[C@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464781279 339153471 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CN(CCc1ccc([N+](=O)[O-])cc1)Cc1cc2ccccc2o1 ZINC000472259164 339367990 /nfs/dbraw/zinc/36/79/90/339367990.db2.gz FRJXMBCBQHFHNB-UHFFFAOYSA-N 0 3 310.353 4.016 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000475328478 339446672 /nfs/dbraw/zinc/44/66/72/339446672.db2.gz BUODRHRIDSJGRI-RHSMWYFYSA-N 0 3 314.360 4.160 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@H]2CC[C@H](c3ccc(F)cc3)C2)cs1 ZINC000475335412 339447274 /nfs/dbraw/zinc/44/72/74/339447274.db2.gz HEHBYMLRVPVHDD-ZFWWWQNUSA-N 0 3 320.389 4.221 20 5 DIBDHN Cc1c(CN[C@H]2c3cc(F)ccc3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000478510803 339516866 /nfs/dbraw/zinc/51/68/66/339516866.db2.gz ZGBWFZZZVYZUCK-ADLMAVQZSA-N 0 3 314.360 4.065 20 5 DIBDHN Cc1c([C@H](C)NCCSc2ccccc2)cccc1[N+](=O)[O-] ZINC000479902420 339553195 /nfs/dbraw/zinc/55/31/95/339553195.db2.gz PAVYNEHQSQCSHG-AWEZNQCLSA-N 0 3 316.426 4.346 20 5 DIBDHN C[C@@H](N[C@@H](c1cccs1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000480247766 339565038 /nfs/dbraw/zinc/56/50/38/339565038.db2.gz MYUNFJYGHLQJHA-BDJLRTHQSA-N 0 3 302.399 4.458 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@@H]1CC[C@H](c2ccccc2F)C1 ZINC000481837735 339615134 /nfs/dbraw/zinc/61/51/34/339615134.db2.gz PVFBARGCAYPVDG-DZGCQCFKSA-N 0 3 314.360 4.160 20 5 DIBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000485713813 339710813 /nfs/dbraw/zinc/71/08/13/339710813.db2.gz AGCSUOARGLWPBH-LLVKDONJSA-N 0 3 313.382 4.055 20 5 DIBDHN CC(C)(NC/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000492371712 339898927 /nfs/dbraw/zinc/89/89/27/339898927.db2.gz ABQBJJODFNDOIN-CLFYSBASSA-N 0 3 314.360 4.272 20 5 DIBDHN CC(C)(NC[C@H]1C[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000492397777 339899538 /nfs/dbraw/zinc/89/95/38/339899538.db2.gz LBTTVODISVGDFN-CVEARBPZSA-N 0 3 310.397 4.223 20 5 DIBDHN C[C@@]1(c2ccccc2)CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000500233856 340053553 /nfs/dbraw/zinc/05/35/53/340053553.db2.gz UXSKTULMTPZFAA-LJQANCHMSA-N 0 3 310.397 4.149 20 5 DIBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1ccsc1 ZINC000504920071 340156155 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CCN(C/C=C/c1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000508708716 340251156 /nfs/dbraw/zinc/25/11/56/340251156.db2.gz DXHSUKPTSZINBI-VMPITWQZSA-N 0 3 316.426 4.234 20 5 DIBDHN CN(CCc1cccc2ccccc21)Cc1ccc([N+](=O)[O-])cc1 ZINC000303134193 340304213 /nfs/dbraw/zinc/30/42/13/340304213.db2.gz OVYAGXBTSZMWOD-UHFFFAOYSA-N 0 3 320.392 4.423 20 5 DIBDHN C[C@]1(c2ccccc2)CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000303528720 340330577 /nfs/dbraw/zinc/33/05/77/340330577.db2.gz DOWFHSGEHJCELE-IBGZPJMESA-N 0 3 310.397 4.149 20 5 DIBDHN C[C@@H](N[C@H]1CCCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000089214371 340466529 /nfs/dbraw/zinc/46/65/29/340466529.db2.gz DZNUZUHZUOTFQP-XIKOKIGWSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1c([C@H](C)NCc2ccc3ncccc3c2)cccc1[N+](=O)[O-] ZINC000195149272 340575140 /nfs/dbraw/zinc/57/51/40/340575140.db2.gz NKUIJEURRJYDFZ-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN Cc1c([C@H](C)N[C@H]2C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000537983335 340795437 /nfs/dbraw/zinc/79/54/37/340795437.db2.gz 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ZINC000564314072 341198254 /nfs/dbraw/zinc/19/82/54/341198254.db2.gz AYRZUAJKORMCCZ-RYBIEJRYSA-N 0 3 323.396 4.230 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000079121497 341253920 /nfs/dbraw/zinc/25/39/20/341253920.db2.gz QHSFMCYWTYXQPC-OLZOCXBDSA-N 0 3 302.349 4.454 20 5 DIBDHN Cc1ccc([C@@H](NCCc2ccccc2[N+](=O)[O-])C2CCC2)o1 ZINC000548710727 341270222 /nfs/dbraw/zinc/27/02/22/341270222.db2.gz SECPSUPERMKFJH-SFHVURJKSA-N 0 3 314.385 4.170 20 5 DIBDHN Cc1ccc2c(c1)[C@H](NCc1cccc([N+](=O)[O-])c1C)[C@H](C)C2 ZINC000577442866 341910104 /nfs/dbraw/zinc/91/01/04/341910104.db2.gz FWDMQLIGZHZPLW-BFUOFWGJSA-N 0 3 310.397 4.235 20 5 DIBDHN CC[C@@H](NC[C@@H](C)c1c(C)noc1C)c1cccc([N+](=O)[O-])c1 ZINC000181630799 522847486 /nfs/dbraw/zinc/84/74/86/522847486.db2.gz MMOCDMLPHLGBGN-BDJLRTHQSA-N 0 3 317.389 4.044 20 5 DIBDHN Cc1cc([C@@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000035253042 1035596083 /nfs/dbraw/zinc/59/60/83/1035596083.db2.gz SAULLVQSDQCBFY-GFCCVEGCSA-N 0 3 304.415 4.432 20 5 DIBDHN CC[C@@H](Cc1ccccc1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000610215757 1035751754 /nfs/dbraw/zinc/75/17/54/1035751754.db2.gz QEHJVDPMAYDTPL-HNNXBMFYSA-N 0 3 304.415 4.109 20 5 DIBDHN CCc1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000226579013 1035845956 /nfs/dbraw/zinc/84/59/56/1035845956.db2.gz NWARBEXRXZXFJJ-GFCCVEGCSA-N 0 3 304.415 4.378 20 5 DIBDHN CCc1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000226579009 1035848283 /nfs/dbraw/zinc/84/82/83/1035848283.db2.gz NWARBEXRXZXFJJ-LBPRGKRZSA-N 0 3 304.415 4.378 20 5 DIBDHN Cc1ccc([C@H]2CCCN2Cc2ccccc2[N+](=O)[O-])s1 ZINC000261448009 1036205304 /nfs/dbraw/zinc/20/53/04/1036205304.db2.gz DCGVKOLEZLJMRQ-OAHLLOKOSA-N 0 3 302.399 4.302 20 5 DIBDHN Cc1cccc([C@@H](C)NCc2ccc([N+](=O)[O-])c(F)c2)c1C ZINC000276258206 1037675711 /nfs/dbraw/zinc/67/57/11/1037675711.db2.gz APMMNRQIAQVVOE-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN CC(C)[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000276305866 1037691544 /nfs/dbraw/zinc/69/15/44/1037691544.db2.gz KYJKJRZTXDOCNN-KRWDZBQOSA-N 0 3 302.349 4.221 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@@H](c1ccccn1)C1CCC1 ZINC000598994167 1038212620 /nfs/dbraw/zinc/21/26/20/1038212620.db2.gz WVTYIZZEGCUGIQ-FUKWUPMWSA-N 0 3 323.396 4.134 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2ccc(CN[C@H]3CCC(F)(F)C3)o2)c1 ZINC000610787724 1038307083 /nfs/dbraw/zinc/30/70/83/1038307083.db2.gz GZMVBPKRNGGCMU-LBPRGKRZSA-N 0 3 322.311 4.132 20 5 DIBDHN CCC[C@@H](C)[C@@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859429 1038381185 /nfs/dbraw/zinc/38/11/85/1038381185.db2.gz RSQWFWPHHXXANI-DOMZBBRYSA-N 0 3 317.389 4.137 20 5 DIBDHN CCC[C@@H](C)[C@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859430 1038381676 /nfs/dbraw/zinc/38/16/76/1038381676.db2.gz RSQWFWPHHXXANI-IUODEOHRSA-N 0 3 317.389 4.137 20 5 DIBDHN CC(C)[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000061558063 1038407997 /nfs/dbraw/zinc/40/79/97/1038407997.db2.gz UHQHZUKUGYTSDY-KRWDZBQOSA-N 0 3 302.349 4.221 20 5 DIBDHN Cc1c(CN[C@@H]2c3cc(F)ccc3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000478510805 1038654412 /nfs/dbraw/zinc/65/44/12/1038654412.db2.gz ZGBWFZZZVYZUCK-VOJFVSQTSA-N 0 3 314.360 4.065 20 5 DIBDHN COc1ccc(CN2CCC3(CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000608833256 1038929357 /nfs/dbraw/zinc/92/93/57/1038929357.db2.gz GGKJLTQPLLXLMD-UHFFFAOYSA-N 0 3 318.417 4.150 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CNC1(c2ccc(F)cc2)CC1 ZINC000540608344 1039528177 /nfs/dbraw/zinc/52/81/77/1039528177.db2.gz UUVWFGLPGNXEIW-HWKANZROSA-N 0 3 312.344 4.026 20 5 DIBDHN CCN(Cc1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])cc1C ZINC000443856748 1039897718 /nfs/dbraw/zinc/89/77/18/1039897718.db2.gz SNAXETDTMCYBGZ-UHFFFAOYSA-N 0 3 323.396 4.407 20 5 DIBDHN Cc1cc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)ccc1Cl ZINC000186757466 1041174496 /nfs/dbraw/zinc/17/44/96/1041174496.db2.gz SPIJPMRUGKKYGD-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN CCOc1cccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)c1 ZINC000180708022 1041198003 /nfs/dbraw/zinc/19/80/03/1041198003.db2.gz RAAUWBGYLWEWFV-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCCc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000122293115 1041387804 /nfs/dbraw/zinc/38/78/04/1041387804.db2.gz ISLGBNIXDUKGCZ-QGZVFWFLSA-N 0 3 314.360 4.210 20 5 DIBDHN C[C@@H]1CC(C)(C)CC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000481086850 1041525237 /nfs/dbraw/zinc/52/52/37/1041525237.db2.gz CWLFOZCTYVZWHX-DGCLKSJQSA-N 0 3 317.389 4.040 20 5 DIBDHN Cc1nnsc1CNCc1c2ccccc2cc2ccccc21 ZINC000813790107 1041732886 /nfs/dbraw/zinc/73/28/86/1041732886.db2.gz GXTWYYQHAKQYQF-UHFFFAOYSA-N 0 3 319.433 4.443 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H](c3ccccc3)C2)cc1F ZINC000814642623 1041846575 /nfs/dbraw/zinc/84/65/75/1041846575.db2.gz JRMQIEVYAVOZPU-MRXNPFEDSA-N 0 3 314.360 4.114 20 5 DIBDHN Cc1cccc([C@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1C ZINC000815580485 1041965519 /nfs/dbraw/zinc/96/55/19/1041965519.db2.gz LEFAYFIIUPJVMQ-KBPBESRZSA-N 0 3 313.401 4.206 20 5 DIBDHN C[C@@H](Cc1ccsc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000049963622 1042053662 /nfs/dbraw/zinc/05/36/62/1042053662.db2.gz GOMCUETYEJLHJX-JTQLQIEISA-N 0 3 310.806 4.031 20 5 DIBDHN CN(Cc1csc([N+](=O)[O-])c1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC001171019855 1042327414 /nfs/dbraw/zinc/32/74/14/1042327414.db2.gz XRNUWANITMOLBX-JKSUJKDBSA-N 0 3 316.426 4.424 20 5 DIBDHN CN(Cc1csc([N+](=O)[O-])c1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC001171019524 1042327962 /nfs/dbraw/zinc/32/79/62/1042327962.db2.gz XRNUWANITMOLBX-CVEARBPZSA-N 0 3 316.426 4.424 20 5 DIBDHN C[C@H](CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433239095 1042461378 /nfs/dbraw/zinc/46/13/78/1042461378.db2.gz JAFOLIIEFPWXFP-RNCFNFMXSA-N 0 3 316.323 4.105 20 5 DIBDHN Cc1oc2ccccc2c1CNCc1ccc([N+](=O)[O-])cc1C ZINC000183912870 1042684482 /nfs/dbraw/zinc/68/44/82/1042684482.db2.gz SMJRYWXTSKRCPT-UHFFFAOYSA-N 0 3 310.353 4.248 20 5 DIBDHN CCC[C@H](NCc1cc(C)cc(N)c1)c1cccc([N+](=O)[O-])c1 ZINC000423478285 1042714900 /nfs/dbraw/zinc/71/49/00/1042714900.db2.gz LAFNRYZONXJIBD-SFHVURJKSA-N 0 3 313.401 4.116 20 5 DIBDHN C[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000178649392 1043135049 /nfs/dbraw/zinc/13/50/49/1043135049.db2.gz KEIHGVVPZULQTE-PIGZYNQJSA-N 0 3 300.333 4.072 20 5 DIBDHN C[C@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000866607006 1043232486 /nfs/dbraw/zinc/23/24/86/1043232486.db2.gz MJQNPINDASVUBQ-ZLKJLUDKSA-N 0 3 314.307 4.143 20 5 DIBDHN CCCNc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000193358213 1043283843 /nfs/dbraw/zinc/28/38/43/1043283843.db2.gz VAWDMBQFJFTFLV-AWEZNQCLSA-N 0 3 313.401 4.268 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)COC2)c1cccc([N+](=O)[O-])c1 ZINC000268811583 1043333348 /nfs/dbraw/zinc/33/33/48/1043333348.db2.gz OCQZHPBTRHTCLK-OLZOCXBDSA-N 0 3 312.369 4.037 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCC(F)(F)C1 ZINC000872058434 1043440840 /nfs/dbraw/zinc/44/08/40/1043440840.db2.gz UNOJYXNMXUZVCW-VHSXEESVSA-N 0 3 316.373 4.155 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCC(F)(F)C1 ZINC000872058432 1043441352 /nfs/dbraw/zinc/44/13/52/1043441352.db2.gz UNOJYXNMXUZVCW-NXEZZACHSA-N 0 3 316.373 4.155 20 5 DIBDHN CCN(Cc1c[nH]c2ccccc12)Cc1cccc([N+](=O)[O-])c1C ZINC000442878815 1043447751 /nfs/dbraw/zinc/44/77/51/1043447751.db2.gz UZHBDGNBGDJKEH-UHFFFAOYSA-N 0 3 323.396 4.407 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1 ZINC000872276850 1043488117 /nfs/dbraw/zinc/48/81/17/1043488117.db2.gz MYVQFQVLEYIMSS-KSSFIOAISA-N 0 3 318.417 4.079 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H](OC2CCC2)CC1 ZINC000872276849 1043488737 /nfs/dbraw/zinc/48/87/37/1043488737.db2.gz MYVQFQVLEYIMSS-KDOFPFPSSA-N 0 3 318.417 4.079 20 5 DIBDHN CSc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000558486009 1043520236 /nfs/dbraw/zinc/52/02/36/1043520236.db2.gz PPEZEKFKVCCNJJ-UHFFFAOYSA-N 0 3 322.455 4.403 20 5 DIBDHN COCC[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000932176704 1044107871 /nfs/dbraw/zinc/10/78/71/1044107871.db2.gz ABQUAUUSZGCOMG-KDOFPFPSSA-N 0 3 314.385 4.023 20 5 DIBDHN CSc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000035256531 1044320485 /nfs/dbraw/zinc/32/04/85/1044320485.db2.gz ICXNPMGCBOLDCF-LBPRGKRZSA-N 0 3 302.399 4.168 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N(C)CC1(c2ccccc2)CC1 ZINC000444669355 1044598284 /nfs/dbraw/zinc/59/82/84/1044598284.db2.gz FEKCCUMCSQINAF-HNNXBMFYSA-N 0 3 310.397 4.319 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](CC(F)(F)F)C1 ZINC000444708411 1044610750 /nfs/dbraw/zinc/61/07/50/1044610750.db2.gz QSCUDNFBSPOHGQ-RYUDHWBXSA-N 0 3 316.323 4.239 20 5 DIBDHN C[C@H](N[C@@H]1CCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000296782951 1044647162 /nfs/dbraw/zinc/64/71/62/1044647162.db2.gz SENDKZZSYFVSPE-APPDUMDISA-N 0 3 300.333 4.072 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H]2CCCc3ncccc32)cc1[N+](=O)[O-] ZINC000601271830 1045209158 /nfs/dbraw/zinc/20/91/58/1045209158.db2.gz UXBAUTCSUQESPQ-DYVFJYSZSA-N 0 3 311.385 4.026 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](c2ccccc2F)C1 ZINC000578120849 1045210726 /nfs/dbraw/zinc/21/07/26/1045210726.db2.gz KTMUDNLXNILFBQ-KBPBESRZSA-N 0 3 314.360 4.284 20 5 DIBDHN Cc1scc(CN[C@H]2CCc3c2cccc3[N+](=O)[O-])c1C ZINC000601292223 1045212944 /nfs/dbraw/zinc/21/29/44/1045212944.db2.gz MDXGZHRKHZHZKF-HNNXBMFYSA-N 0 3 302.399 4.050 20 5 DIBDHN Cc1cc2cc(CN[C@H]3CCc4c3cccc4[N+](=O)[O-])ccc2[nH]1 ZINC000578642921 1045260315 /nfs/dbraw/zinc/26/03/15/1045260315.db2.gz GUZKKVACCRTPJR-SFHVURJKSA-N 0 3 321.380 4.162 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccc(C2CC2)cc1 ZINC000579024857 1045289543 /nfs/dbraw/zinc/28/95/43/1045289543.db2.gz TWYXNDCBVSGXQR-SFHVURJKSA-N 0 3 308.381 4.249 20 5 DIBDHN C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1Cc1ccc([N+](=O)[O-])cc1 ZINC000449357528 1045385483 /nfs/dbraw/zinc/38/54/83/1045385483.db2.gz AWYQLPPOXGLNJR-LOWVWBTDSA-N 0 3 316.323 4.146 20 5 DIBDHN O=[N+]([O-])c1cccc(CN2CCC(c3cccc(F)c3)CC2)c1 ZINC000752094853 1045658266 /nfs/dbraw/zinc/65/82/66/1045658266.db2.gz WPDCSCJXUUQTRM-UHFFFAOYSA-N 0 3 314.360 4.114 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1 ZINC000752090097 1045658370 /nfs/dbraw/zinc/65/83/70/1045658370.db2.gz SMQXSWWLQCDMGM-UHFFFAOYSA-N 0 3 314.360 4.114 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN1CCC(c2ccc(F)cc2)CC1 ZINC000752092822 1045658667 /nfs/dbraw/zinc/65/86/67/1045658667.db2.gz FJBKIGHBTASNML-UHFFFAOYSA-N 0 3 314.360 4.114 20 5 DIBDHN C[C@]1(NCc2ccc([N+](=O)[O-])c(F)c2)CCCc2ccccc21 ZINC000801523284 1045731871 /nfs/dbraw/zinc/73/18/71/1045731871.db2.gz NUZDLFWERMMDGP-SFHVURJKSA-N 0 3 314.360 4.075 20 5 DIBDHN C[C@@H](N[C@@H]1CCCc2c(F)cccc21)c1cccc([N+](=O)[O-])c1 ZINC000453232006 1045997571 /nfs/dbraw/zinc/99/75/71/1045997571.db2.gz IYBNGLBWXWPXRP-KZULUSFZSA-N 0 3 314.360 4.462 20 5 DIBDHN CCOc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000532207291 1046109746 /nfs/dbraw/zinc/10/97/46/1046109746.db2.gz KLZYMIYHLNUCFS-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN CC[C@H](N[C@@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903426917 1046274956 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CCc1cc(N2Cc3ccc([N+](=O)[O-])cc3C2)c2ccccc2n1 ZINC001116356967 1047132213 /nfs/dbraw/zinc/13/22/13/1047132213.db2.gz ZMORFXQFOGRGPQ-UHFFFAOYSA-N 0 3 319.364 4.226 20 5 DIBDHN C[C@@]1(O)CCN(Cc2c3ccccc3cc3ccccc32)C[C@@H]1F ZINC001141722711 1047276036 /nfs/dbraw/zinc/27/60/36/1047276036.db2.gz FXGCCPGTRXMZPQ-LEWJYISDSA-N 0 3 323.411 4.288 20 5 DIBDHN COC(=O)[C@H]1CCCN1Cc1c2ccccc2cc2ccccc21 ZINC001141722908 1047278331 /nfs/dbraw/zinc/27/83/31/1047278331.db2.gz JTCNXBZBTATBQG-HXUWFJFHSA-N 0 3 319.404 4.130 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H](c2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000537948160 1047645677 /nfs/dbraw/zinc/64/56/77/1047645677.db2.gz ZUIWDACSCRPKLD-SCLBCKFNSA-N 0 3 311.385 4.100 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H]1CSc2ccccc21 ZINC000538400308 1047672214 /nfs/dbraw/zinc/67/22/14/1047672214.db2.gz OINGZALERZKWRZ-KEDPEKRHSA-N 0 3 312.394 4.045 20 5 DIBDHN Cc1ccc2cc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)[nH]c2c1 ZINC001199413041 1048063859 /nfs/dbraw/zinc/06/38/59/1048063859.db2.gz KWBAJBVXEDALLO-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN O=[N+]([O-])c1cc(CNCCc2cc3ccccc3s2)cs1 ZINC000555619118 1048409825 /nfs/dbraw/zinc/40/98/25/1048409825.db2.gz ZLTNQPLOWXDSRU-UHFFFAOYSA-N 0 3 318.423 4.203 20 5 DIBDHN C[C@H](NCc1cc([N+](=O)[O-])ccc1Cl)C(C)(C)C(F)F ZINC000850443117 1048658320 /nfs/dbraw/zinc/65/83/20/1048658320.db2.gz AXGGBSGVPDQWNG-QMMMGPOBSA-N 0 3 306.740 4.018 20 5 DIBDHN Cc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC001177328990 1048872298 /nfs/dbraw/zinc/87/22/98/1048872298.db2.gz YPQYVSOIAXDHKU-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)CN(CC[C@H]1CCc3ccccc31)CC2 ZINC001191520689 1048957297 /nfs/dbraw/zinc/95/72/97/1048957297.db2.gz JNZOBBHTKPYIJR-QGZVFWFLSA-N 0 3 322.408 4.073 20 5 DIBDHN CCC[C@@H](C)[C@@H]1CCCN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001192173984 1049053794 /nfs/dbraw/zinc/05/37/94/1049053794.db2.gz NPNBACQFZOTYFL-DOMZBBRYSA-N 0 3 324.396 4.143 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCS[C@H](C(C)C)C1 ZINC001204681217 1049221416 /nfs/dbraw/zinc/22/14/16/1049221416.db2.gz ITYWLQUBJOKAGV-ZGUWOUCSSA-N 0 3 320.458 4.072 20 5 DIBDHN CC[C@H](CN(CC)Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC001193593171 1049229465 /nfs/dbraw/zinc/22/94/65/1049229465.db2.gz JPMDXIHWFHAKMF-OAHLLOKOSA-N 0 3 313.401 4.006 20 5 DIBDHN CC[C@@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180198864 1049315920 /nfs/dbraw/zinc/31/59/20/1049315920.db2.gz KNSSROFWCVXBTF-LLVKDONJSA-N 0 3 316.323 4.236 20 5 DIBDHN COc1cc(CN(Cc2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000485716114 1049324312 /nfs/dbraw/zinc/32/43/12/1049324312.db2.gz KQUPUMMDGRNBIX-UHFFFAOYSA-N 0 3 314.385 4.014 20 5 DIBDHN C=Cc1ccc(CCNCc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC001181947088 1049553229 /nfs/dbraw/zinc/55/32/29/1049553229.db2.gz XMFUAKUCPOSTEB-UHFFFAOYSA-N 0 3 316.788 4.224 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cccc3[nH]ccc32)cc1[N+](=O)[O-] ZINC000175057230 1049648213 /nfs/dbraw/zinc/64/82/13/1049648213.db2.gz WSRNMOUEOQAKDB-CYBMUJFWSA-N 0 3 309.369 4.235 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H](c1cccs1)C1CC1 ZINC000571820821 1049967421 /nfs/dbraw/zinc/96/74/21/1049967421.db2.gz WTUZMRCEVVXYRK-YOEHRIQHSA-N 0 3 314.410 4.385 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC2(CC2(F)F)CC1 ZINC000593072475 1050383310 /nfs/dbraw/zinc/38/33/10/1050383310.db2.gz HQRKNUOIYNNMGZ-LBPRGKRZSA-N 0 3 310.344 4.085 20 5 DIBDHN COc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000595108071 1050608060 /nfs/dbraw/zinc/60/80/60/1050608060.db2.gz YHYCWILKYUNHOH-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN CSc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000595417694 1050630851 /nfs/dbraw/zinc/63/08/51/1050630851.db2.gz YHBBSODYANIVIQ-LBPRGKRZSA-N 0 3 302.399 4.168 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@]3(CC=CCC3)C2)cc1F ZINC000788480999 1050687536 /nfs/dbraw/zinc/68/75/36/1050687536.db2.gz NOIAKOXDJLFNRO-KRWDZBQOSA-N 0 3 304.365 4.056 20 5 DIBDHN C[C@H](N[C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1c(Cl)cccc1Cl ZINC001168978359 1051475135 /nfs/dbraw/zinc/47/51/35/1051475135.db2.gz RHJBAVQIVYUDDS-GARJFASQSA-N 0 3 317.216 4.089 20 5 DIBDHN O=[N+]([O-])c1ccc(CNCCSc2ccccc2)cc1Cl ZINC000761522429 1051584819 /nfs/dbraw/zinc/58/48/19/1051584819.db2.gz PWFQROCANRIMBL-UHFFFAOYSA-N 0 3 322.817 4.130 20 5 DIBDHN C[C@H]1Cc2ccccc2[C@@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522468 1051585095 /nfs/dbraw/zinc/58/50/95/1051585095.db2.gz ZCUODFGLUNDYPH-APPDUMDISA-N 0 3 316.788 4.271 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)s1 ZINC000761524111 1051585360 /nfs/dbraw/zinc/58/53/60/1051585360.db2.gz VEIAGZUJGSSLHH-JTQLQIEISA-N 0 3 310.806 4.469 20 5 DIBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1cc(F)ccc1Cl ZINC001173215693 1051633089 /nfs/dbraw/zinc/63/30/89/1051633089.db2.gz YQAHVNOIDSKZKY-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN Cc1cc(C)c2ccc3cccc(O[C@H]4CCNC[C@H]4F)c3c2n1 ZINC001218073115 1052192983 /nfs/dbraw/zinc/19/29/83/1052192983.db2.gz YWURGIATTRTVRR-SJORKVTESA-N 0 3 324.399 4.084 20 5 DIBDHN CC(C)c1ccc2c(c1)[C@@H](NCc1cccc([N+](=O)[O-])c1)CC2 ZINC000495154474 1052238369 /nfs/dbraw/zinc/23/83/69/1052238369.db2.gz CKDLUYVYPKUCBW-IBGZPJMESA-N 0 3 310.397 4.495 20 5 DIBDHN C[C@H](NCc1ccc(OC(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000193234382 1052260850 /nfs/dbraw/zinc/26/08/50/1052260850.db2.gz JCVSJNILFRAPHX-NSHDSACASA-N 0 3 322.311 4.047 20 5 DIBDHN COc1cccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193899957 1052510369 /nfs/dbraw/zinc/51/03/69/1052510369.db2.gz NPMPSEOWKVJQRW-STQMWFEESA-N 0 3 300.358 4.015 20 5 DIBDHN CC1CCC(N(Cc2cc(F)ccc2[N+](=O)[O-])C2CC2)CC1 ZINC000917064981 1052688452 /nfs/dbraw/zinc/68/84/52/1052688452.db2.gz NMTJDWGKIGVSOX-UHFFFAOYSA-N 0 3 306.381 4.277 20 5 DIBDHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609672580 1052986256 /nfs/dbraw/zinc/98/62/56/1052986256.db2.gz QQCHMEVSFCTPRU-DZGCQCFKSA-N 0 3 314.360 4.112 20 5 DIBDHN CC(C)(NCc1ccc2cnccc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000618725882 1053353080 /nfs/dbraw/zinc/35/30/80/1053353080.db2.gz XUPMTMJLGLISDP-UHFFFAOYSA-N 0 3 321.380 4.168 20 5 DIBDHN C[C@@H](N[C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000619754175 1053547399 /nfs/dbraw/zinc/54/73/99/1053547399.db2.gz LUKXPAZBTFQZCU-BZNIZROVSA-N 0 3 302.399 4.385 20 5 DIBDHN CSc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000037775650 1053563151 /nfs/dbraw/zinc/56/31/51/1053563151.db2.gz YHEMCFPTWVDCBE-GFCCVEGCSA-N 0 3 302.399 4.168 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN(CCCc1ccccc1)C1CC1 ZINC001473294577 1054514305 /nfs/dbraw/zinc/51/43/05/1054514305.db2.gz QSZGUHLMQZEHSV-UHFFFAOYSA-N 0 3 310.397 4.192 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC2(CCCCC2)C1 ZINC001615454483 1056512976 /nfs/dbraw/zinc/51/29/76/1056512976.db2.gz YVCPOBBAYQIGTP-UHFFFAOYSA-N 0 3 318.417 4.150 20 5 DIBDHN c1ccc2cc3cc(-c4ncc5c(n4)CCNC5)ccc3cc2c1 ZINC001240680164 1056637099 /nfs/dbraw/zinc/63/70/99/1056637099.db2.gz PSQJISGKWPHORC-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001616661803 1056697029 /nfs/dbraw/zinc/69/70/29/1056697029.db2.gz IZBDPEMFTSLDJL-AWEZNQCLSA-N 0 3 310.397 4.243 20 5 DIBDHN CCc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000156289170 1057075923 /nfs/dbraw/zinc/07/59/23/1057075923.db2.gz IXXKPZWXPRQBHS-LBPRGKRZSA-N 0 3 304.415 4.378 20 5 DIBDHN CCC[C@@H](N[C@H](C)c1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000611299973 1057590951 /nfs/dbraw/zinc/59/09/51/1057590951.db2.gz UGRCVQHPUHWAHH-RDTXWAMCSA-N 0 3 313.401 4.490 20 5 DIBDHN C[C@H]1CCC[C@@H](CCN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001559595110 1059428421 /nfs/dbraw/zinc/42/84/21/1059428421.db2.gz YSZIULCOKWAMOO-GJZGRUSLSA-N 0 3 302.418 4.169 20 5 DIBDHN CCOc1cc(CN2CCC(C)(C(C)C)CC2)ccc1[N+](=O)[O-] ZINC001559770599 1059606456 /nfs/dbraw/zinc/60/64/56/1059606456.db2.gz PGTBWUYLBWQVPF-UHFFFAOYSA-N 0 3 320.433 4.252 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@H](C2CCCC2)C1 ZINC001559925507 1059742101 /nfs/dbraw/zinc/74/21/01/1059742101.db2.gz VAHWJIMLXMBGPL-ZDUSSCGKSA-N 0 3 308.809 4.260 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CC[C@@H](C2CCCCC2)C1 ZINC001559977468 1059785846 /nfs/dbraw/zinc/78/58/46/1059785846.db2.gz WDVFVCPSNNFMEJ-CQSZACIVSA-N 0 3 306.381 4.136 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(c2ccco2)CC1 ZINC001559982051 1059790684 /nfs/dbraw/zinc/79/06/84/1059790684.db2.gz GZBIGRVWZFCIGD-AWEZNQCLSA-N 0 3 314.385 4.437 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCc2c(C)cccc2C1 ZINC001560684581 1060531069 /nfs/dbraw/zinc/53/10/69/1060531069.db2.gz ROLWLOAZFBDXHY-RVDMUPIBSA-N 0 3 322.408 4.365 20 5 DIBDHN C[C@H](CCN1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC001560697652 1060552491 /nfs/dbraw/zinc/55/24/91/1060552491.db2.gz JJGRYUALKZPKQP-OAHLLOKOSA-N 0 3 310.397 4.147 20 5 DIBDHN CCO[C@H]1C[C@H](N(C)Cc2ccccc2[N+](=O)[O-])C1(CC)CC ZINC001473243449 1061018851 /nfs/dbraw/zinc/01/88/51/1061018851.db2.gz KANSHPYGIORPIY-IRXDYDNUSA-N 0 3 320.433 4.010 20 5 DIBDHN C[C@@H](N[C@@H]1CS[C@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC001462556605 1061259322 /nfs/dbraw/zinc/25/93/22/1061259322.db2.gz MKKVRROJAXHFKK-XUJVJEKNSA-N 0 3 308.447 4.166 20 5 DIBDHN CC1(C)CCC[C@@H]1[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC001473576816 1061264927 /nfs/dbraw/zinc/26/49/27/1061264927.db2.gz BQGJNGJNZPSITR-UKRRQHHQSA-N 0 3 320.408 4.382 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)c(CNC2(C3CCCCC3)CC2)c1 ZINC001473871218 1061441597 /nfs/dbraw/zinc/44/15/97/1061441597.db2.gz VVYRFRIJIBGFAN-UHFFFAOYSA-N 0 3 308.809 4.451 20 5 DIBDHN C[C@H](N(C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1(C)CC1 ZINC001474330478 1061917113 /nfs/dbraw/zinc/91/71/13/1061917113.db2.gz XGASIJTXFAUXQY-JTQLQIEISA-N 0 3 316.323 4.234 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1c(F)cccc1Cl ZINC001254534690 1062164125 /nfs/dbraw/zinc/16/41/25/1062164125.db2.gz BBPHYAQOMHVPGE-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1cc(F)ccc1Cl ZINC001254535479 1062164922 /nfs/dbraw/zinc/16/49/22/1062164922.db2.gz KLDQUPBTFWNYBA-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1cccc(F)c1Cl ZINC001254539322 1062166586 /nfs/dbraw/zinc/16/65/86/1062166586.db2.gz HDCNNDKCYRNDPA-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN CC1(C)CCC[C@@H]1[C@H]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001460295351 1062763586 /nfs/dbraw/zinc/76/35/86/1062763586.db2.gz IKKMDUDRZFVEOY-XJKSGUPXSA-N 0 3 320.408 4.382 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2C2CCC2)c(Cl)c1 ZINC001460342828 1062791608 /nfs/dbraw/zinc/79/16/08/1062791608.db2.gz MEKWENCMGVNAQG-MRXNPFEDSA-N 0 3 308.809 4.403 20 5 DIBDHN COc1ccc(CN2CCC[C@H](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC001460675174 1062979325 /nfs/dbraw/zinc/97/93/25/1062979325.db2.gz VYTGOFJIGFBTFA-INIZCTEOSA-N 0 3 318.417 4.006 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](C(C)(C)C)CC1 ZINC001473165433 1063468864 /nfs/dbraw/zinc/46/88/64/1063468864.db2.gz ALQJYPOLOWLYMP-HNNXBMFYSA-N 0 3 320.433 4.252 20 5 DIBDHN CSC(C)(C)CCN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001461869989 1063764259 /nfs/dbraw/zinc/76/42/59/1063764259.db2.gz OMXQUYHHLSFVNP-UHFFFAOYSA-N 0 3 308.447 4.091 20 5 DIBDHN C[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 ZINC000903289821 1066103967 /nfs/dbraw/zinc/10/39/67/1066103967.db2.gz YEYLPKBFFNFMOG-ZIAGYGMSSA-N 0 3 313.401 4.073 20 5 DIBDHN C[C@@H]1CCCCCN1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001308700882 1066187085 /nfs/dbraw/zinc/18/70/85/1066187085.db2.gz DHESGBXEBYJNDS-LLVKDONJSA-N 0 3 316.323 4.378 20 5 DIBDHN Cc1ccc(CC2CN(Cc3c(C)ccc([N+](=O)[O-])c3C)C2)cc1 ZINC001308867121 1066349712 /nfs/dbraw/zinc/34/97/12/1066349712.db2.gz JTJJWTHQYXXXAR-UHFFFAOYSA-N 0 3 324.424 4.195 20 5 DIBDHN CCCO[C@@H]1CCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182772179 335001699 /nfs/dbraw/zinc/00/16/99/335001699.db2.gz SIQCBHRAQJBUHH-DOTOQJQBSA-N 0 3 320.433 4.245 20 5 DIBDHN Cc1ccsc1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278279351 130677271 /nfs/dbraw/zinc/67/72/71/130677271.db2.gz PXBYQHJJBYHLLB-HNNXBMFYSA-N 0 3 302.399 4.132 20 5 DIBDHN CSCc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000284946858 131125604 /nfs/dbraw/zinc/12/56/04/131125604.db2.gz BOOCCTHQMKRMMW-CYBMUJFWSA-N 0 3 316.426 4.309 20 5 DIBDHN CCC[C@@H](NCc1sc(C)nc1C)c1cccc([N+](=O)[O-])c1 ZINC000119854926 132138552 /nfs/dbraw/zinc/13/85/52/132138552.db2.gz YYDNCYYLULFPHF-OAHLLOKOSA-N 0 3 319.430 4.299 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000172831374 332818483 /nfs/dbraw/zinc/81/84/83/332818483.db2.gz OVYWJCCNEVHARN-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3C[C@@H]3C(F)F)s2)cc1 ZINC000558132258 331878752 /nfs/dbraw/zinc/87/87/52/331878752.db2.gz OZPCELKWBLGMGN-STQMWFEESA-N 0 3 324.352 4.067 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCCC[C@@H]1C(F)(F)F ZINC000569484868 332101785 /nfs/dbraw/zinc/10/17/85/332101785.db2.gz ONTPHWLORUQDGE-UONOGXRCSA-N 0 3 316.323 4.114 20 5 DIBDHN Cc1c(CNC2CC(c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000323147152 332352612 /nfs/dbraw/zinc/35/26/12/332352612.db2.gz CWMDHGJSMGLOCH-UHFFFAOYSA-N 0 3 314.360 4.078 20 5 DIBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1cccc(F)c1 ZINC000318448938 332730464 /nfs/dbraw/zinc/73/04/64/332730464.db2.gz BGURFONEACPUIQ-INIZCTEOSA-N 0 3 302.349 4.283 20 5 DIBDHN C[C@@H]1[C@H](c2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000531202365 333330668 /nfs/dbraw/zinc/33/06/68/333330668.db2.gz ULQRNEXDGQSTCL-IUODEOHRSA-N 0 3 302.399 4.034 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000062726409 333336176 /nfs/dbraw/zinc/33/61/76/333336176.db2.gz UTXNVYDHCLHZGC-SNVBAGLBSA-N 0 3 310.806 4.203 20 5 DIBDHN Cc1c(CN[C@H]2CCCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000323536937 333374992 /nfs/dbraw/zinc/37/49/92/333374992.db2.gz YVAKSZORIZQENJ-SFHVURJKSA-N 0 3 310.397 4.461 20 5 DIBDHN C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCC2 ZINC000390856927 333400204 /nfs/dbraw/zinc/40/02/04/333400204.db2.gz ADDPHCGHHQDQNK-KBPBESRZSA-N 0 3 310.397 4.495 20 5 DIBDHN COc1cccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000268783049 333994159 /nfs/dbraw/zinc/99/41/59/333994159.db2.gz JFXJOZBRTDLGJZ-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN CSCCCN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000467555270 334267944 /nfs/dbraw/zinc/26/79/44/334267944.db2.gz UPBWFCUXNVDBLK-UHFFFAOYSA-N 0 3 320.414 4.040 20 5 DIBDHN COc1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000535084931 334367033 /nfs/dbraw/zinc/36/70/33/334367033.db2.gz GLPMRQGTTUTAKC-UHFFFAOYSA-N 0 3 314.385 4.014 20 5 DIBDHN Cc1c2ccccc2n(C)c1CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000326905351 335651265 /nfs/dbraw/zinc/65/12/65/335651265.db2.gz LVSMXVFDZFXWQR-CQSZACIVSA-N 0 3 323.396 4.246 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCc2c1cccc2F ZINC000532462998 336248850 /nfs/dbraw/zinc/24/88/50/336248850.db2.gz RLWBKGMEIXDGMD-XIKOKIGWSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCc1c(F)cccc1F ZINC000532473143 336249682 /nfs/dbraw/zinc/24/96/82/336249682.db2.gz TZTOZKARGAZDQT-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(F)cc1 ZINC000389494196 336396711 /nfs/dbraw/zinc/39/67/11/336396711.db2.gz TXJYFWVCAGAJLU-INIZCTEOSA-N 0 3 302.349 4.283 20 5 DIBDHN C[C@H]1CCCC[C@H]1OCCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429262114 337156601 /nfs/dbraw/zinc/15/66/01/337156601.db2.gz DJXZQCAEOZAOBU-WMLDXEAASA-N 0 3 320.433 4.015 20 5 DIBDHN CC1(C)CC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000583314842 337314093 /nfs/dbraw/zinc/31/40/93/337314093.db2.gz WAHAZVNHDXGELC-MRXNPFEDSA-N 0 3 300.358 4.133 20 5 DIBDHN COc1cc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000161786607 337597238 /nfs/dbraw/zinc/59/72/38/337597238.db2.gz NPSVJSCDMGVPGB-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN CCOCCN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000161879729 337598360 /nfs/dbraw/zinc/59/83/60/337598360.db2.gz FQPDOUBAKHTUJP-GFCCVEGCSA-N 0 3 320.414 4.010 20 5 DIBDHN CC1(C)C[C@H](N[C@@H]2CCCC(F)(F)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433294398 337728338 /nfs/dbraw/zinc/72/83/38/337728338.db2.gz LRRCOKGJERTCBI-ABAIWWIYSA-N 0 3 324.371 4.485 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC34CC4)o2)c(Cl)c1 ZINC000424186334 337802066 /nfs/dbraw/zinc/80/20/66/337802066.db2.gz RWTRMVKUDSCLIT-OAHLLOKOSA-N 0 3 318.760 4.150 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)ccc1F ZINC000119404999 337859342 /nfs/dbraw/zinc/85/93/42/337859342.db2.gz WYIZCDFIRUUVOQ-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN CC(C)C[C@@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000537320101 337930900 /nfs/dbraw/zinc/93/09/00/337930900.db2.gz BEBIXIROOPKEBV-GFCCVEGCSA-N 0 3 319.430 4.243 20 5 DIBDHN CCC(C)(C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000428550306 338056036 /nfs/dbraw/zinc/05/60/36/338056036.db2.gz QUABBAVXCSDOOL-UHFFFAOYSA-N 0 3 319.430 4.244 20 5 DIBDHN Cc1ccccc1CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433125871 338182463 /nfs/dbraw/zinc/18/24/63/338182463.db2.gz MESJIOWRQRJAEQ-SFHVURJKSA-N 0 3 310.397 4.415 20 5 DIBDHN Cc1ccsc1CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433155196 338183309 /nfs/dbraw/zinc/18/33/09/338183309.db2.gz WWXQDOKQEJKQAI-OAHLLOKOSA-N 0 3 316.426 4.477 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000437099225 338300771 /nfs/dbraw/zinc/30/07/71/338300771.db2.gz QKNLIOHXRGUWAK-GXFFZTMASA-N 0 3 304.312 4.222 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H](c1cccnc1)C1CC1)CCC2 ZINC000447587074 338559780 /nfs/dbraw/zinc/55/97/80/338559780.db2.gz OJACXLWKPWIDQY-RBUKOAKNSA-N 0 3 323.396 4.108 20 5 DIBDHN Cc1csc(CNCc2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000449481927 338629359 /nfs/dbraw/zinc/62/93/59/338629359.db2.gz WSEVSIKBKPHRKX-UHFFFAOYSA-N 0 3 304.415 4.378 20 5 DIBDHN C[C@@H]1CCCc2ccccc2[C@@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000462542537 339081021 /nfs/dbraw/zinc/08/10/21/339081021.db2.gz NDZULZWYQYCTKV-AUUYWEPGSA-N 0 3 310.397 4.398 20 5 DIBDHN CCS[C@H]1CC[C@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464781277 339153387 /nfs/dbraw/zinc/15/33/87/339153387.db2.gz XXAPCKZLKPPIAX-GJZGRUSLSA-N 0 3 308.447 4.009 20 5 DIBDHN C[C@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000464849776 339157775 /nfs/dbraw/zinc/15/77/75/339157775.db2.gz IQYLYRVVVDPGQN-YOEHRIQHSA-N 0 3 314.385 4.204 20 5 DIBDHN C[C@@H](NC[C@H]1CCC2(CCCCC2)O1)c1ccccc1[N+](=O)[O-] ZINC000467189507 339227517 /nfs/dbraw/zinc/22/75/17/339227517.db2.gz DXQSCENFCKTLGW-HUUCEWRRSA-N 0 3 318.417 4.127 20 5 DIBDHN C[C@@H](NC[C@H]1CCC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000467209575 339228376 /nfs/dbraw/zinc/22/83/76/339228376.db2.gz XPCFSGZUNYIVHL-RHSMWYFYSA-N 0 3 318.417 4.127 20 5 DIBDHN C[C@H](NCCSCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000467847421 339247584 /nfs/dbraw/zinc/24/75/84/339247584.db2.gz YBUJXFUXXGMWSJ-AWEZNQCLSA-N 0 3 316.426 4.179 20 5 DIBDHN Cc1ccccc1O[C@@H](C)CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467863508 339248021 /nfs/dbraw/zinc/24/80/21/339248021.db2.gz NXWZEDDSFJFQJG-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000467969976 339250243 /nfs/dbraw/zinc/25/02/43/339250243.db2.gz OIFRHJILQJTODE-CYBMUJFWSA-N 0 3 310.353 4.234 20 5 DIBDHN Cc1ccc(SC[C@H](C)NCc2csc([N+](=O)[O-])c2)cc1 ZINC000472151756 339364449 /nfs/dbraw/zinc/36/44/49/339364449.db2.gz GHPDCGGWICSPOV-LBPRGKRZSA-N 0 3 322.455 4.235 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CCCC4(CC4)C3)o2)c1 ZINC000473072736 339380971 /nfs/dbraw/zinc/38/09/71/339380971.db2.gz NDBZMSLJTLRYAR-UHFFFAOYSA-N 0 3 312.369 4.231 20 5 DIBDHN Cc1ccc([C@@H](C)NCCc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000481311099 339600787 /nfs/dbraw/zinc/60/07/87/339600787.db2.gz KLVCZQGPEVIOEM-GFCCVEGCSA-N 0 3 320.339 4.075 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@@H]2CC[C@H](c3ccccc3F)C2)cs1 ZINC000481820730 339614595 /nfs/dbraw/zinc/61/45/95/339614595.db2.gz YAYUPOJSDCTHLI-QWHCGFSZSA-N 0 3 320.389 4.221 20 5 DIBDHN C[C@@H](NCc1cc2ccc(F)cc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000486717815 339732393 /nfs/dbraw/zinc/73/23/93/339732393.db2.gz AYTKFKBZAFSOHL-LLVKDONJSA-N 0 3 313.332 4.066 20 5 DIBDHN CO[C@H](c1ccccc1)[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000491906428 339886535 /nfs/dbraw/zinc/88/65/35/339886535.db2.gz BDBITVGTGXMZSK-LBTNJELSSA-N 0 3 314.385 4.022 20 5 DIBDHN Cc1ccc2c(c1)[C@H](NCc1ccc(C)c([N+](=O)[O-])c1)CCC2 ZINC000492237394 339895050 /nfs/dbraw/zinc/89/50/50/339895050.db2.gz BCLDCGKCSIGXTF-GOSISDBHSA-N 0 3 310.397 4.379 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC3CCC3)o2)c(Cl)c1 ZINC000501365882 340079208 /nfs/dbraw/zinc/07/92/08/340079208.db2.gz WUGBKVOTBPNCTH-UHFFFAOYSA-N 0 3 306.749 4.150 20 5 DIBDHN Cc1c(CN2CC[C@H](c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000503709578 340134098 /nfs/dbraw/zinc/13/40/98/340134098.db2.gz QCNPNMKRLMFTBR-HNNXBMFYSA-N 0 3 314.360 4.032 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN(Cc1cccs1)C1CC1 ZINC000506618177 340197921 /nfs/dbraw/zinc/19/79/21/340197921.db2.gz SJOPDZNEGMQHRB-UTCJRWHESA-N 0 3 314.410 4.334 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(Cc2cccc3[nH]ccc32)C2CC2)cc1 ZINC000507169235 340210722 /nfs/dbraw/zinc/21/07/22/340210722.db2.gz UXNHKBKLFBVCBG-UHFFFAOYSA-N 0 3 321.380 4.241 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(Cc2cccc3cc[nH]c32)C2CC2)cc1 ZINC000507169932 340210946 /nfs/dbraw/zinc/21/09/46/340210946.db2.gz LAVXIMFOURGJDY-UHFFFAOYSA-N 0 3 321.380 4.241 20 5 DIBDHN Cc1sccc1CN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507251077 340215616 /nfs/dbraw/zinc/21/56/16/340215616.db2.gz FVAASOBWIPUBTL-UHFFFAOYSA-N 0 3 304.415 4.375 20 5 DIBDHN C[C@@H](c1cccs1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507442263 340219765 /nfs/dbraw/zinc/21/97/65/340219765.db2.gz OBPSXGPPHFHHEV-UJZCVKTISA-N 0 3 302.399 4.363 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(C2CC2)[C@H]2CCc3ccccc32)cc1 ZINC000510665839 340305683 /nfs/dbraw/zinc/30/56/83/340305683.db2.gz RZWISLQCUBTDCZ-IBGZPJMESA-N 0 3 308.381 4.247 20 5 DIBDHN C[C@H](NC/C=C/c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000512101956 340348598 /nfs/dbraw/zinc/34/85/98/340348598.db2.gz WQECZTCQOLNFDN-PCAWENJQSA-N 0 3 318.323 4.237 20 5 DIBDHN C[C@@H]1CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000513073588 340392113 /nfs/dbraw/zinc/39/21/13/340392113.db2.gz CRCGPPJUBMVDLD-MEBBXXQBSA-N 0 3 320.776 4.396 20 5 DIBDHN C[C@H](NCCSc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000037904138 340787927 /nfs/dbraw/zinc/78/79/27/340787927.db2.gz KWLBLGFELWRNOC-ZDUSSCGKSA-N 0 3 302.399 4.038 20 5 DIBDHN Cc1ccc([C@@H](C)NC[C@H]2CCC3(CCCC3)O2)cc1[N+](=O)[O-] ZINC000530359073 340789292 /nfs/dbraw/zinc/78/92/92/340789292.db2.gz AVSHQFXNWKMBDF-GDBMZVCRSA-N 0 3 318.417 4.046 20 5 DIBDHN C[C@@H](NCCc1cc2ccccc2o1)c1ccc([N+](=O)[O-])cc1 ZINC000539076219 340871046 /nfs/dbraw/zinc/87/10/46/340871046.db2.gz MSDODIJSUYVKKT-CYBMUJFWSA-N 0 3 310.353 4.234 20 5 DIBDHN Cc1ccc([C@H](C)NC[C@H](C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000539084369 340871742 /nfs/dbraw/zinc/87/17/42/340871742.db2.gz SBGQRTFGTDLJBK-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccc([C@@H](C)NC[C@@H](C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000539084370 340871794 /nfs/dbraw/zinc/87/17/94/340871794.db2.gz SBGQRTFGTDLJBK-HUUCEWRRSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccc([C@@H](C)NCCCCc2ccc([N+](=O)[O-])cc2)o1 ZINC000539088961 340872442 /nfs/dbraw/zinc/87/24/42/340872442.db2.gz GDPGAGWTNOELCU-CQSZACIVSA-N 0 3 302.374 4.170 20 5 DIBDHN C[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000540150325 340917444 /nfs/dbraw/zinc/91/74/44/340917444.db2.gz INNOKMQUCLUNLF-GFCCVEGCSA-N 0 3 304.777 4.142 20 5 DIBDHN O=[N+]([O-])c1ccccc1CNC[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000540610038 340938784 /nfs/dbraw/zinc/93/87/84/340938784.db2.gz JMGXXMLKUKZHRH-YPMHNXCESA-N 0 3 316.323 4.053 20 5 DIBDHN CC[C@@H](CC(F)(F)F)N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000546165499 341155383 /nfs/dbraw/zinc/15/53/83/341155383.db2.gz HJXKMUQSPRJRNB-QWRGUYRKSA-N 0 3 304.312 4.285 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000546873232 341184676 /nfs/dbraw/zinc/18/46/76/341184676.db2.gz QYKGDHJEZNCXBA-GHMZBOCLSA-N 0 3 304.312 4.285 20 5 DIBDHN Cc1ccccc1CC(C)(C)NCc1csc([N+](=O)[O-])c1 ZINC000237718652 341219077 /nfs/dbraw/zinc/21/90/77/341219077.db2.gz BHHRRSALGHAHDO-UHFFFAOYSA-N 0 3 304.415 4.076 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(F)c1 ZINC000547726911 341228988 /nfs/dbraw/zinc/22/89/88/341228988.db2.gz YVPIEBRRHPIXBQ-LLVKDONJSA-N 0 3 322.767 4.281 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)cc1[N+](=O)[O-] ZINC000552339811 341387760 /nfs/dbraw/zinc/38/77/60/341387760.db2.gz DPHHQRRFGHZBRN-QWHCGFSZSA-N 0 3 324.384 4.191 20 5 DIBDHN CC(C)(NCc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000175985722 341855027 /nfs/dbraw/zinc/85/50/27/341855027.db2.gz FJIWHZKEZAZVNI-UHFFFAOYSA-N 0 3 304.777 4.273 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1nccc2ccccc21 ZINC000577564681 341918067 /nfs/dbraw/zinc/91/80/67/341918067.db2.gz RUIZUYUIYITGFV-CQSZACIVSA-N 0 3 321.380 4.036 20 5 DIBDHN Cc1c([C@H](C)NCc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000178043132 341942265 /nfs/dbraw/zinc/94/22/65/341942265.db2.gz TVZKCJHFGXDOID-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN CN1CC=C(Nc2c(N)c3ccccc3c3ccccc32)CC1 ZINC001208911230 1035936332 /nfs/dbraw/zinc/93/63/32/1035936332.db2.gz ZGSNBXAKYZILKV-UHFFFAOYSA-N 0 3 303.409 4.207 20 5 DIBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCC(C)(C)O1 ZINC001167188238 1036253827 /nfs/dbraw/zinc/25/38/27/1036253827.db2.gz YPQUYVHYBUBSCB-KRWDZBQOSA-N 0 3 320.433 4.153 20 5 DIBDHN C[C@@H](c1cccc(O)c1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255677319 1037240981 /nfs/dbraw/zinc/24/09/81/1037240981.db2.gz UWGSTIYXRNIHQY-PIZKADEWSA-N 0 3 312.369 4.007 20 5 DIBDHN CC[C@@H](C)[C@H]1CCCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582169 1037643518 /nfs/dbraw/zinc/64/35/18/1037643518.db2.gz FMNRXWVGYZTTOT-IUODEOHRSA-N 0 3 317.389 4.137 20 5 DIBDHN CC(C)(NCc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000119380529 1037688195 /nfs/dbraw/zinc/68/81/95/1037688195.db2.gz FTHPQLSJCBCRJV-UHFFFAOYSA-N 0 3 304.777 4.273 20 5 DIBDHN CCC[C@@H]1[C@@H](C)CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582555 1038203514 /nfs/dbraw/zinc/20/35/14/1038203514.db2.gz XTEIMDQGGIYWLA-SWLSCSKDSA-N 0 3 317.389 4.137 20 5 DIBDHN Cc1csc([C@@H](C)NCCCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000599033555 1038217698 /nfs/dbraw/zinc/21/76/98/1038217698.db2.gz WUTUMJKYCXBMTC-CYBMUJFWSA-N 0 3 319.430 4.033 20 5 DIBDHN CSc1ccc([C@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000075756158 1038822371 /nfs/dbraw/zinc/82/23/71/1038822371.db2.gz ROQZQDKXJUACME-ZDUSSCGKSA-N 0 3 316.426 4.476 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCSC2(CCC2)CC1 ZINC000411871452 1040638897 /nfs/dbraw/zinc/63/88/97/1040638897.db2.gz RQQBTARKNVOLNZ-CYBMUJFWSA-N 0 3 306.431 4.017 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCSC2(CCC2)CC1 ZINC000411869399 1040639231 /nfs/dbraw/zinc/63/92/31/1040639231.db2.gz MUTPCVWVSAUUJY-CYBMUJFWSA-N 0 3 306.431 4.017 20 5 DIBDHN NCc1nn(-c2nc3ccccc3c3ccccc32)c2ccccc12 ZINC001167699790 1041163532 /nfs/dbraw/zinc/16/35/32/1041163532.db2.gz ACEFNWABTBWJCG-UHFFFAOYSA-N 0 3 324.387 4.186 20 5 DIBDHN C[C@H](C1CC1)N(C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809933903 1041275659 /nfs/dbraw/zinc/27/56/59/1041275659.db2.gz ZRBUJFUQBOMVNF-MRVPVSSYSA-N 0 3 303.189 4.132 20 5 DIBDHN C[C@@H](C1CC1)N(C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809933904 1041274660 /nfs/dbraw/zinc/27/46/60/1041274660.db2.gz ZRBUJFUQBOMVNF-QMMMGPOBSA-N 0 3 303.189 4.132 20 5 DIBDHN Cc1cc(F)ccc1[C@@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000815566055 1041964046 /nfs/dbraw/zinc/96/40/46/1041964046.db2.gz HPEOIYVHAUVBDP-QWHCGFSZSA-N 0 3 302.349 4.454 20 5 DIBDHN Cc1cccc([C@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1C ZINC000815580486 1041966123 /nfs/dbraw/zinc/96/61/23/1041966123.db2.gz LEFAYFIIUPJVMQ-KGLIPLIRSA-N 0 3 313.401 4.206 20 5 DIBDHN C[C@H](Cc1ccsc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000049963623 1042054087 /nfs/dbraw/zinc/05/40/87/1042054087.db2.gz GOMCUETYEJLHJX-SNVBAGLBSA-N 0 3 310.806 4.031 20 5 DIBDHN CC(C)(NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000067011170 1042141372 /nfs/dbraw/zinc/14/13/72/1042141372.db2.gz QTRODTFXFUCIGP-UHFFFAOYSA-N 0 3 304.777 4.273 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000067248274 1042489038 /nfs/dbraw/zinc/48/90/38/1042489038.db2.gz VWCRKJODHINXKA-JTQLQIEISA-N 0 3 310.806 4.469 20 5 DIBDHN Cc1ccc(CN2CC[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000513467132 1042545046 /nfs/dbraw/zinc/54/50/46/1042545046.db2.gz QIJAWDCIMRDHRG-INIZCTEOSA-N 0 3 314.360 4.032 20 5 DIBDHN CC[C@@H](Cc1ccc(C)cc1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000441326308 1043036085 /nfs/dbraw/zinc/03/60/85/1043036085.db2.gz DZPVDVJVLPOKND-INIZCTEOSA-N 0 3 318.442 4.418 20 5 DIBDHN C[C@H](N[C@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000178649410 1043134536 /nfs/dbraw/zinc/13/45/36/1043134536.db2.gz KEIHGVVPZULQTE-GTNSWQLSSA-N 0 3 300.333 4.072 20 5 DIBDHN CCOc1cccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178651311 1043135517 /nfs/dbraw/zinc/13/55/17/1043135517.db2.gz PLAQSKLGORRNNW-ZIAGYGMSSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000866607849 1043233268 /nfs/dbraw/zinc/23/32/68/1043233268.db2.gz VQRJKFJMVMXYCY-CYZMBNFOSA-N 0 3 314.307 4.143 20 5 DIBDHN CCCNc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193363500 1043284556 /nfs/dbraw/zinc/28/45/56/1043284556.db2.gz PGDATJJVUHSBMP-AWEZNQCLSA-N 0 3 313.401 4.268 20 5 DIBDHN CCCNc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193363515 1043284942 /nfs/dbraw/zinc/28/49/42/1043284942.db2.gz PGDATJJVUHSBMP-CQSZACIVSA-N 0 3 313.401 4.268 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000269023790 1043351093 /nfs/dbraw/zinc/35/10/93/1043351093.db2.gz QHALGRYLHUEWTN-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN CC(C)N(Cc1ccc(CF)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000777560063 1043414570 /nfs/dbraw/zinc/41/45/70/1043414570.db2.gz OCWQORKNHZHVCS-UHFFFAOYSA-N 0 3 316.376 4.475 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCC(F)(F)C1 ZINC000872058435 1043442342 /nfs/dbraw/zinc/44/23/42/1043442342.db2.gz UNOJYXNMXUZVCW-ZJUUUORDSA-N 0 3 316.373 4.155 20 5 DIBDHN CC1=C(c2ccco2)CN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000558733563 1043583102 /nfs/dbraw/zinc/58/31/02/1043583102.db2.gz HQSCIAOPDZXMLC-AWEZNQCLSA-N 0 3 312.369 4.428 20 5 DIBDHN Cc1cccc2c1OCC[C@@H]2NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000353234882 1043592650 /nfs/dbraw/zinc/59/26/50/1043592650.db2.gz ZGYZRUUUAZVCOY-AFCDSYGPSA-N 0 3 324.380 4.030 20 5 DIBDHN CC[C@@H](N[C@@H](C)c1ccc2n[nH]cc2c1)c1cccc([N+](=O)[O-])c1 ZINC000353970133 1043666394 /nfs/dbraw/zinc/66/63/94/1043666394.db2.gz BXBFGGQYZCGTRF-YVEFUNNKSA-N 0 3 324.384 4.273 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc(CF)cc2)cc1[N+](=O)[O-] ZINC000777725189 1043784536 /nfs/dbraw/zinc/78/45/36/1043784536.db2.gz HGQOKCXEHJITJV-CYBMUJFWSA-N 0 3 302.349 4.224 20 5 DIBDHN Cc1nc([C@@H](C)NCCCCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000358208506 1044035612 /nfs/dbraw/zinc/03/56/12/1044035612.db2.gz VICFTWDNNJGNNE-GFCCVEGCSA-N 0 3 319.430 4.033 20 5 DIBDHN CSc1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000567974346 1044594500 /nfs/dbraw/zinc/59/45/00/1044594500.db2.gz PYVZUTZQMLMKNQ-UHFFFAOYSA-N 0 3 322.455 4.053 20 5 DIBDHN CCOc1ccc([C@@H](C)N[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000089553225 1044741891 /nfs/dbraw/zinc/74/18/91/1044741891.db2.gz NYZKCMXDYBMNNI-ZIAGYGMSSA-N 0 3 314.385 4.405 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[C@@H](F)C2)c2ccccc2)c1 ZINC000577239114 1045109389 /nfs/dbraw/zinc/10/93/89/1045109389.db2.gz LXXHDARKXRNGQC-SOLBZPMBSA-N 0 3 314.360 4.164 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1F ZINC000447535771 1045141790 /nfs/dbraw/zinc/14/17/90/1045141790.db2.gz IHCOKJILVQTWPU-SFHVURJKSA-N 0 3 314.360 4.210 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](c2ccccc2F)C1 ZINC000578120852 1045210582 /nfs/dbraw/zinc/21/05/82/1045210582.db2.gz KTMUDNLXNILFBQ-ZIAGYGMSSA-N 0 3 314.360 4.284 20 5 DIBDHN Cc1cc(C(F)(F)F)ccc1CNCc1ccc([N+](=O)[O-])cc1 ZINC000190844625 1045619654 /nfs/dbraw/zinc/61/96/54/1045619654.db2.gz SUYCCDYIVUEAGH-UHFFFAOYSA-N 0 3 324.302 4.212 20 5 DIBDHN C[C@H]1[C@@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801522048 1045730899 /nfs/dbraw/zinc/73/08/99/1045730899.db2.gz XZRDHSVIBFGBQR-BBRMVZONSA-N 0 3 314.360 4.112 20 5 DIBDHN CCCN(Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000520173280 1045861451 /nfs/dbraw/zinc/86/14/51/1045861451.db2.gz BBMLXFDFJZLYAM-UHFFFAOYSA-N 0 3 302.349 4.146 20 5 DIBDHN C[C@H]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2)c2sccc21 ZINC000453138552 1045955270 /nfs/dbraw/zinc/95/52/70/1045955270.db2.gz AOQHHXCCZFQMCN-NHYWBVRUSA-N 0 3 302.399 4.385 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783739993 1046629972 /nfs/dbraw/zinc/62/99/72/1046629972.db2.gz FZJNAJACEZVIJM-NSHDSACASA-N 0 3 324.730 4.315 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CCCOc1ccccc1 ZINC000302768278 1046802001 /nfs/dbraw/zinc/80/20/01/1046802001.db2.gz XCMJLYNRPNKISA-OAHLLOKOSA-N 0 3 314.385 4.057 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1C1CCC1 ZINC000303170835 1046884736 /nfs/dbraw/zinc/88/47/36/1046884736.db2.gz BKEFSJSMSFQELN-QGZVFWFLSA-N 0 3 318.417 4.147 20 5 DIBDHN CCOc1ccc([C@@H](C)NCc2ccccc2C)cc1[N+](=O)[O-] ZINC000152606075 1047449505 /nfs/dbraw/zinc/44/95/05/1047449505.db2.gz ZBAYUWJCJWLSSS-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H]1CCc2ccc(F)cc21 ZINC000537980250 1047650105 /nfs/dbraw/zinc/65/01/05/1047650105.db2.gz ORUUZGXBNHEBGD-XIKOKIGWSA-N 0 3 314.360 4.380 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC2(Cc3ccccc3)CC2)c(Cl)c1 ZINC000479395078 1047880047 /nfs/dbraw/zinc/88/00/47/1047880047.db2.gz SNCNUFYICQHDFZ-UHFFFAOYSA-N 0 3 316.788 4.113 20 5 DIBDHN C[C@H](COCC1CCCCC1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001198000662 1047911822 /nfs/dbraw/zinc/91/18/22/1047911822.db2.gz IQYOZCKCQXWWPD-CABCVRRESA-N 0 3 320.433 4.231 20 5 DIBDHN C[C@H](COCC1CCCCC1)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC001198000664 1047912010 /nfs/dbraw/zinc/91/20/10/1047912010.db2.gz IQYOZCKCQXWWPD-HUUCEWRRSA-N 0 3 320.433 4.231 20 5 DIBDHN COc1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000479557145 1047929615 /nfs/dbraw/zinc/92/96/15/1047929615.db2.gz NPEVYIOEJJZNBA-UHFFFAOYSA-N 0 3 314.385 4.014 20 5 DIBDHN CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCCCCCC1 ZINC000776100300 1048145538 /nfs/dbraw/zinc/14/55/38/1048145538.db2.gz OGQWHGDZHMUAAG-UHFFFAOYSA-N 0 3 316.405 4.016 20 5 DIBDHN CSc1cccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000852095528 1048823904 /nfs/dbraw/zinc/82/39/04/1048823904.db2.gz AKPFYPUOYFQLHT-LBPRGKRZSA-N 0 3 302.399 4.168 20 5 DIBDHN Cc1cc(C)c(/C=C/CNCc2ccc([N+](=O)[O-])cc2)cc1C ZINC001177416096 1048887446 /nfs/dbraw/zinc/88/74/46/1048887446.db2.gz HZDKIOGRWNSCOE-SNAWJCMRSA-N 0 3 310.397 4.323 20 5 DIBDHN CCCc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000856789638 1049105947 /nfs/dbraw/zinc/10/59/47/1049105947.db2.gz MKIPWVSIFYIMPO-LBPRGKRZSA-N 0 3 304.415 4.460 20 5 DIBDHN CC[C@@H](C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001179105667 1049131594 /nfs/dbraw/zinc/13/15/94/1049131594.db2.gz KXHCLPWMBQGOCI-GFCCVEGCSA-N 0 3 319.430 4.244 20 5 DIBDHN C/C(=C\c1ccccc1)CN(C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001193372884 1049204091 /nfs/dbraw/zinc/20/40/91/1049204091.db2.gz FSMNBSJTYNKCHE-RVDMUPIBSA-N 0 3 310.397 4.439 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCc3ccc(Cl)cc32)cc1[N+](=O)[O-] ZINC000858320797 1049242232 /nfs/dbraw/zinc/24/22/32/1049242232.db2.gz JBNHICBRPVTJRP-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN N[C@H]1CN(Cc2ccc3ccc4cccc5ccc2c3c45)C[C@@H]1F ZINC001204892302 1049301485 /nfs/dbraw/zinc/30/14/85/1049301485.db2.gz WVFXAHQZHHHRDX-OALUTQOASA-N 0 3 318.395 4.065 20 5 DIBDHN CCCN(Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485812626 1049346745 /nfs/dbraw/zinc/34/67/45/1049346745.db2.gz HXHFZXORMSNNMD-UHFFFAOYSA-N 0 3 314.385 4.016 20 5 DIBDHN Cc1cccc2[nH]c(CN(C)CCc3ccccc3[N+](=O)[O-])cc21 ZINC001205755878 1049554723 /nfs/dbraw/zinc/55/47/23/1049554723.db2.gz PEISLHMNAFPGEN-UHFFFAOYSA-N 0 3 323.396 4.059 20 5 DIBDHN COc1ccc(CN2CC(C)(C)CCC2(C)C)cc1[N+](=O)[O-] ZINC001196276844 1049636525 /nfs/dbraw/zinc/63/65/25/1049636525.db2.gz WVVJOTHZNMLSCF-UHFFFAOYSA-N 0 3 306.406 4.004 20 5 DIBDHN COc1ccc(CN2CC[C@]2(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC001197241083 1049732022 /nfs/dbraw/zinc/73/20/22/1049732022.db2.gz YNZFPQYLUABSGZ-GOSISDBHSA-N 0 3 318.417 4.148 20 5 DIBDHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000734488142 1050277581 /nfs/dbraw/zinc/27/75/81/1050277581.db2.gz ZLMOEVGNEKBXGO-UKRRQHHQSA-N 0 3 314.360 4.112 20 5 DIBDHN Cc1cccc2c1CC[C@@H]2N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574583952 1050496217 /nfs/dbraw/zinc/49/62/17/1050496217.db2.gz RTHQUQPEAJGYLN-ROUUACIJSA-N 0 3 308.381 4.168 20 5 DIBDHN CSc1ccc(CN(C)CCc2cccc([N+](=O)[O-])c2)s1 ZINC000574563699 1050498109 /nfs/dbraw/zinc/49/81/09/1050498109.db2.gz OGTDIRYPSRVPSI-UHFFFAOYSA-N 0 3 322.455 4.053 20 5 DIBDHN Cc1cc(CNCc2c3ccccc3cc3ccccc32)[nH]n1 ZINC000738430700 1050534383 /nfs/dbraw/zinc/53/43/83/1050534383.db2.gz INZARVXQULLPES-UHFFFAOYSA-N 0 3 301.393 4.314 20 5 DIBDHN CCOc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000594927144 1050566049 /nfs/dbraw/zinc/56/60/49/1050566049.db2.gz YHMMNEUPORHROT-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H]1CCc3ccccc31)CCC2 ZINC000595076300 1050607478 /nfs/dbraw/zinc/60/74/78/1050607478.db2.gz HXJPFVYXYCHWTB-RBUKOAKNSA-N 0 3 308.381 4.249 20 5 DIBDHN COc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000595108073 1050608335 /nfs/dbraw/zinc/60/83/35/1050608335.db2.gz YHYCWILKYUNHOH-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN COc1ccc2c(c1)nccc2NCc1cccc([N+](=O)[O-])c1C ZINC000790788031 1050995144 /nfs/dbraw/zinc/99/51/44/1050995144.db2.gz YGXBPDIWBKNMMB-UHFFFAOYSA-N 0 3 323.352 4.072 20 5 DIBDHN O=[N+]([O-])c1ccc(F)c(Nc2ccnc(C3CCC3)c2)c1F ZINC001215291672 1051153260 /nfs/dbraw/zinc/15/32/60/1051153260.db2.gz BHCOWTRDPNIDHE-UHFFFAOYSA-N 0 3 305.284 4.279 20 5 DIBDHN CCC[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC001168775175 1051237830 /nfs/dbraw/zinc/23/78/30/1051237830.db2.gz NJJOFJQXZIBGEG-MRXNPFEDSA-N 0 3 314.385 4.234 20 5 DIBDHN C[C@@H](N[C@H]1CC[C@H](C[N+](=O)[O-])C1)c1c(Cl)cccc1Cl ZINC001168988369 1051491605 /nfs/dbraw/zinc/49/16/05/1051491605.db2.gz RHJBAVQIVYUDDS-VWYCJHECSA-N 0 3 317.216 4.089 20 5 DIBDHN CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CCc2ccccc21 ZINC000761506927 1051583705 /nfs/dbraw/zinc/58/37/05/1051583705.db2.gz PWSYYTCMOYETSF-MRXNPFEDSA-N 0 3 316.788 4.368 20 5 DIBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H](C)c1c(F)cccc1F ZINC001173220350 1051637037 /nfs/dbraw/zinc/63/70/37/1051637037.db2.gz YRTFTMSXYJIGGE-RYUDHWBXSA-N 0 3 320.339 4.155 20 5 DIBDHN COc1cccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193900003 1052511051 /nfs/dbraw/zinc/51/10/51/1052511051.db2.gz NPMPSEOWKVJQRW-CHWSQXEVSA-N 0 3 300.358 4.015 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193900948 1052511258 /nfs/dbraw/zinc/51/12/58/1052511258.db2.gz ZHSOPGIUEYCQEK-CHWSQXEVSA-N 0 3 300.358 4.015 20 5 DIBDHN Cc1ccc(CNC2(c3ccccc3)CCCC2)cc1[N+](=O)[O-] ZINC000237760759 1053024858 /nfs/dbraw/zinc/02/48/58/1053024858.db2.gz XBYOUYIUIQUYSZ-UHFFFAOYSA-N 0 3 310.397 4.462 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc3cnccc3c2)cc1[N+](=O)[O-] ZINC000618725858 1053354204 /nfs/dbraw/zinc/35/42/04/1053354204.db2.gz WKMOMJQNIBIXHH-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN Clc1c2ccccc2c(CN2CC3(COC3)C2)c2ccccc12 ZINC001231826389 1053879176 /nfs/dbraw/zinc/87/91/76/1053879176.db2.gz HCYRPGRVSHZKJU-UHFFFAOYSA-N 0 3 323.823 4.479 20 5 DIBDHN Cc1ccc([C@H](C)NC/C=C\c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001200810688 1053998222 /nfs/dbraw/zinc/99/82/22/1053998222.db2.gz AAMYRGILJFACSN-NQHOJNORSA-N 0 3 314.360 4.406 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1cccc(C(F)F)c1 ZINC001329742251 1054006409 /nfs/dbraw/zinc/00/64/09/1054006409.db2.gz BDCXHAZGQMHFQM-UHFFFAOYSA-N 0 3 320.339 4.439 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccccc2CF)cc1[N+](=O)[O-] ZINC001335613644 1054221289 /nfs/dbraw/zinc/22/12/89/1054221289.db2.gz PMXDPCQUEYPGPI-CYBMUJFWSA-N 0 3 302.349 4.224 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1cccc2cccnc21 ZINC001620757052 1055927197 /nfs/dbraw/zinc/92/71/97/1055927197.db2.gz VUEKTKHMBHQYMR-UHFFFAOYSA-N 0 3 321.380 4.050 20 5 DIBDHN CC(C)CN(CCc1ccccc1)Cc1csc([N+](=O)[O-])c1 ZINC001615280006 1056486544 /nfs/dbraw/zinc/48/65/44/1056486544.db2.gz HWFTWLBFFRTEBN-UHFFFAOYSA-N 0 3 318.442 4.357 20 5 DIBDHN C[C@@]1(CCc2ccccc2)CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC001615806293 1056578466 /nfs/dbraw/zinc/57/84/66/1056578466.db2.gz QNVHMCAOZNEZCL-HXUWFJFHSA-N 0 3 324.424 4.440 20 5 DIBDHN C[C@H]1[C@@H](c2ccccc2)CCN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001615804481 1056578941 /nfs/dbraw/zinc/57/89/41/1056578941.db2.gz DTOUCILLYKKXSM-GUYCJALGSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001615804477 1056579368 /nfs/dbraw/zinc/57/93/68/1056579368.db2.gz DTOUCILLYKKXSM-DYVFJYSZSA-N 0 3 314.360 4.112 20 5 DIBDHN CCCCC[C@@H]1CCCN1Cc1cc([N+](=O)[O-])ccc1OC ZINC001616333100 1056635941 /nfs/dbraw/zinc/63/59/41/1056635941.db2.gz WPEIHJWUIPPUDM-OAHLLOKOSA-N 0 3 306.406 4.148 20 5 DIBDHN CCCN(Cc1ccc(OC)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000603926154 1057159682 /nfs/dbraw/zinc/15/96/82/1057159682.db2.gz NLCZMXTZCSBNCQ-UHFFFAOYSA-N 0 3 314.385 4.016 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc2n1 ZINC000171762444 1057240734 /nfs/dbraw/zinc/24/07/34/1057240734.db2.gz CGCQEZWQAFVAFC-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]1c1ccc(O)cc1 ZINC000611265466 1057587523 /nfs/dbraw/zinc/58/75/23/1057587523.db2.gz SSTWOYIHGTXBGI-HNSSHINMSA-N 0 3 324.380 4.151 20 5 DIBDHN CC[C@H](NCc1ccc2cc[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC001559703417 1059532058 /nfs/dbraw/zinc/53/20/58/1059532058.db2.gz XBFFWZVQRYFVAA-KRWDZBQOSA-N 0 3 309.369 4.317 20 5 DIBDHN C[C@@H](NCc1ccc2scnc2c1)c1ccc([N+](=O)[O-])cc1 ZINC001560587394 1060400017 /nfs/dbraw/zinc/40/00/17/1060400017.db2.gz KVAQLCODDGKHAI-LLVKDONJSA-N 0 3 313.382 4.055 20 5 DIBDHN CS[C@@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC001560752390 1060618832 /nfs/dbraw/zinc/61/88/32/1060618832.db2.gz CQCAVRNPKGTHEJ-ZDUSSCGKSA-N 0 3 316.854 4.116 20 5 DIBDHN Cc1c(CN2CC([C@@H]3CCC[C@@H](C)C3)C2)cccc1[N+](=O)[O-] ZINC001560977763 1060842294 /nfs/dbraw/zinc/84/22/94/1060842294.db2.gz JSPLBKBJOZAVBN-UKRRQHHQSA-N 0 3 302.418 4.161 20 5 DIBDHN CCCCO[C@H]1C[C@H](N[C@H](C)c2ccccc2[N+](=O)[O-])C1(C)C ZINC001560995446 1060856595 /nfs/dbraw/zinc/85/65/95/1060856595.db2.gz MNYBZKGAZHHRMF-COXVUDFISA-N 0 3 320.433 4.229 20 5 DIBDHN CC[C@@H](C)CN(CC)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001473204488 1060971867 /nfs/dbraw/zinc/97/18/67/1060971867.db2.gz SMDMDIOOABQGCK-CQSZACIVSA-N 0 3 308.422 4.250 20 5 DIBDHN CCO[C@H]1C[C@@H](N(C)Cc2ccccc2[N+](=O)[O-])C1(CC)CC ZINC001473243451 1061018152 /nfs/dbraw/zinc/01/81/52/1061018152.db2.gz KANSHPYGIORPIY-SJORKVTESA-N 0 3 320.433 4.010 20 5 DIBDHN C/C(=C/c1ccccc1)CN(C)Cc1cccc([N+](=O)[O-])c1C ZINC001473378383 1061122493 /nfs/dbraw/zinc/12/24/93/1061122493.db2.gz DCLYNYZIKYZKPV-QINSGFPZSA-N 0 3 310.397 4.439 20 5 DIBDHN CN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1C(C)(C)C ZINC001473565485 1061253518 /nfs/dbraw/zinc/25/35/18/1061253518.db2.gz TUCNQYMMLJAPBZ-XJKSGUPXSA-N 0 3 308.397 4.381 20 5 DIBDHN C[C@@H](N[C@@H]1CS[C@@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC001462556601 1061258893 /nfs/dbraw/zinc/25/88/93/1061258893.db2.gz MKKVRROJAXHFKK-TYNCELHUSA-N 0 3 308.447 4.166 20 5 DIBDHN CC(C)(C)N(Cc1ccsc1)Cc1cccc([N+](=O)[O-])c1 ZINC001473634887 1061309125 /nfs/dbraw/zinc/30/91/25/1061309125.db2.gz XBUIPSMDYYMROU-UHFFFAOYSA-N 0 3 304.415 4.457 20 5 DIBDHN C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1csc([N+](=O)[O-])c1 ZINC001473818833 1061423505 /nfs/dbraw/zinc/42/35/05/1061423505.db2.gz XGDJNHHLSQXEES-CJNGLKHVSA-N 0 3 316.426 4.424 20 5 DIBDHN CCC[C@@H]1CCCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001473859007 1061436957 /nfs/dbraw/zinc/43/69/57/1061436957.db2.gz ARLGAJPLQNQUPJ-OAHLLOKOSA-N 0 3 306.406 4.147 20 5 DIBDHN CC(C)C1CCC(CN2CCc3ccc([N+](=O)[O-])cc3C2)CC1 ZINC001474381760 1062026425 /nfs/dbraw/zinc/02/64/25/1062026425.db2.gz PIMVPXCSQJKXHV-UHFFFAOYSA-N 0 3 316.445 4.415 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)Cc1ccc(F)cc1 ZINC001474414966 1062082958 /nfs/dbraw/zinc/08/29/58/1062082958.db2.gz JMEAHWPDSSLNPO-UVTDQMKNSA-N 0 3 314.360 4.269 20 5 DIBDHN CC(C)(NCc1ccc2cc[nH]c2c1)c1ccc([N+](=O)[O-])cc1 ZINC001474423763 1062097349 /nfs/dbraw/zinc/09/73/49/1062097349.db2.gz BKQMGFHQPFEQPW-UHFFFAOYSA-N 0 3 309.369 4.101 20 5 DIBDHN CCN(Cc1ccccc1F)[C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254560925 1062180521 /nfs/dbraw/zinc/18/05/21/1062180521.db2.gz ZSOFYOFSWKQFDF-CQSZACIVSA-N 0 3 316.376 4.187 20 5 DIBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC001459623600 1062259501 /nfs/dbraw/zinc/25/95/01/1062259501.db2.gz MEHJQNHWXLJYLV-DYVFJYSZSA-N 0 3 314.360 4.112 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN1CCC(C2CCCCC2)CC1 ZINC001460364294 1062806931 /nfs/dbraw/zinc/80/69/31/1062806931.db2.gz BCVPXZQNHYDVCD-UHFFFAOYSA-N 0 3 302.418 4.387 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1cccc(Cl)c1 ZINC001461001651 1063177135 /nfs/dbraw/zinc/17/71/35/1063177135.db2.gz YFAUGIUIFSNPPS-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN Cc1cc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F ZINC001461254213 1063367972 /nfs/dbraw/zinc/36/79/72/1063367972.db2.gz HPWFSZZWAIXPGX-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc2cccnc12 ZINC001461756676 1063699676 /nfs/dbraw/zinc/69/96/76/1063699676.db2.gz WDKXXJFHLJMART-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)Cc1cccc(F)c1 ZINC001462031289 1063892567 /nfs/dbraw/zinc/89/25/67/1063892567.db2.gz NVTCFDUOVJVPQP-ZROIWOOFSA-N 0 3 314.360 4.269 20 5 DIBDHN Cc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc2cccnc12 ZINC001308207492 1065815922 /nfs/dbraw/zinc/81/59/22/1065815922.db2.gz ADROFVUAOWSRIX-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CN(c1ccccc1)c1ccc(CN[C@@H]2C=CCC2)cc1[N+](=O)[O-] ZINC001308457951 1066001762 /nfs/dbraw/zinc/00/17/62/1066001762.db2.gz MEUQQENUMXTHHK-MRXNPFEDSA-N 0 3 323.396 4.171 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(OCC(C)C)CC1 ZINC000182682228 335000244 /nfs/dbraw/zinc/00/02/44/335000244.db2.gz LDQSTAOGMMRGIT-OAHLLOKOSA-N 0 3 320.433 4.101 20 5 DIBDHN CCCO[C@H]1CCCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182772196 335001717 /nfs/dbraw/zinc/00/17/17/335001717.db2.gz SIQCBHRAQJBUHH-RDJZCZTQSA-N 0 3 320.433 4.245 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCCc3sccc32)cc1[N+](=O)[O-] ZINC000061360083 184168804 /nfs/dbraw/zinc/16/88/04/184168804.db2.gz LAYKIBYXGOBANN-CQSZACIVSA-N 0 3 302.399 4.132 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000273115076 130090340 /nfs/dbraw/zinc/09/03/40/130090340.db2.gz XDVNXAOMOJGOBS-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN CSCc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000285720720 131196581 /nfs/dbraw/zinc/19/65/81/131196581.db2.gz QFADSKGMZBNGRW-CYBMUJFWSA-N 0 3 316.426 4.309 20 5 DIBDHN COc1cccc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000119649555 132135464 /nfs/dbraw/zinc/13/54/64/132135464.db2.gz VBSIVVHMHXQFFI-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN CCN(Cc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000518474634 332061648 /nfs/dbraw/zinc/06/16/48/332061648.db2.gz PUMJHNUAWYRQIS-CYBMUJFWSA-N 0 3 302.349 4.317 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H](c1ccccc1)C1CC1 ZINC000571656030 334075178 /nfs/dbraw/zinc/07/51/78/334075178.db2.gz YMDWLYFYAJEJTH-MJGOQNOKSA-N 0 3 308.381 4.323 20 5 DIBDHN Cc1ccc2cc(CN[C@H](C)c3cccc([N+](=O)[O-])c3)ccc2n1 ZINC000187640873 334266410 /nfs/dbraw/zinc/26/64/10/334266410.db2.gz UYTHOQHGIHJKLJ-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN Cc1cccc(O[C@@H](C)CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000467851221 334607409 /nfs/dbraw/zinc/60/74/09/334607409.db2.gz BLEKMGDQAVXKHV-LSDHHAIUSA-N 0 3 314.385 4.021 20 5 DIBDHN O=[N+]([O-])c1cccc([C@@H](NC[C@@H]2CC23CC3)c2ccccc2)c1 ZINC000417330100 334709188 /nfs/dbraw/zinc/70/91/88/334709188.db2.gz AGENACRAQYGWAE-WMZOPIPTSA-N 0 3 308.381 4.074 20 5 DIBDHN CCO[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000193432464 336896921 /nfs/dbraw/zinc/89/69/21/336896921.db2.gz PBLNRNZRBWSEJC-KBXCAEBGSA-N 0 3 314.385 4.023 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H](c1cccs1)C1CC1 ZINC000571820819 337578209 /nfs/dbraw/zinc/57/82/09/337578209.db2.gz WTUZMRCEVVXYRK-RHSMWYFYSA-N 0 3 314.410 4.385 20 5 DIBDHN CCC[C@@H](NCc1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000120459648 337874335 /nfs/dbraw/zinc/87/43/35/337874335.db2.gz PHSDEWFQKNSTFM-QGZVFWFLSA-N 0 3 302.349 4.365 20 5 DIBDHN Cc1ccc(CN(C)Cc2cccc3[nH]ccc32)cc1[N+](=O)[O-] ZINC000426371651 338029212 /nfs/dbraw/zinc/02/92/12/338029212.db2.gz LVLMQVLNRWCRPM-UHFFFAOYSA-N 0 3 309.369 4.017 20 5 DIBDHN CC(C)(NCCCCC1CCOCC1)c1ccccc1[N+](=O)[O-] ZINC000429239422 338074357 /nfs/dbraw/zinc/07/43/57/338074357.db2.gz UIBKSOWJYBLFQU-UHFFFAOYSA-N 0 3 320.433 4.016 20 5 DIBDHN Cc1cscc1CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433059013 338179044 /nfs/dbraw/zinc/17/90/44/338179044.db2.gz BZZLHXLZJDZXDL-INIZCTEOSA-N 0 3 316.426 4.477 20 5 DIBDHN CN(CCC1CCCCC1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000434840475 338226330 /nfs/dbraw/zinc/22/63/30/338226330.db2.gz BLJZWWIDCBJRNK-UHFFFAOYSA-N 0 3 317.389 4.138 20 5 DIBDHN C[C@@H](N[C@H]1C[C@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000436305053 338267860 /nfs/dbraw/zinc/26/78/60/338267860.db2.gz HISQHCBWJYVUDK-BPLDGKMQSA-N 0 3 314.360 4.331 20 5 DIBDHN C[C@H](N[C@H]1C[C@H](c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000436305054 338267948 /nfs/dbraw/zinc/26/79/48/338267948.db2.gz HISQHCBWJYVUDK-QEJZJMRPSA-N 0 3 314.360 4.331 20 5 DIBDHN CSCCCCNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000167381536 339053527 /nfs/dbraw/zinc/05/35/27/339053527.db2.gz MECLKKYUONMNPC-UHFFFAOYSA-N 0 3 305.403 4.007 20 5 DIBDHN C[C@@H]1CCCc2ccccc2[C@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000462542539 339080945 /nfs/dbraw/zinc/08/09/45/339080945.db2.gz NDZULZWYQYCTKV-KUHUBIRLSA-N 0 3 310.397 4.398 20 5 DIBDHN CCC[C@@]1(C)CCCN(Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000464833438 339156298 /nfs/dbraw/zinc/15/62/98/339156298.db2.gz DTQFXFCIOHURTA-KRWDZBQOSA-N 0 3 306.406 4.006 20 5 DIBDHN C[C@H](NC[C@@H]1CCC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000467209579 339228337 /nfs/dbraw/zinc/22/83/37/339228337.db2.gz XPCFSGZUNYIVHL-YOEHRIQHSA-N 0 3 318.417 4.127 20 5 DIBDHN C[C@H](NCCc1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000467838009 339247211 /nfs/dbraw/zinc/24/72/11/339247211.db2.gz DKSGGUCDEULZLR-LBPRGKRZSA-N 0 3 304.777 4.142 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1 ZINC000467969937 339250270 /nfs/dbraw/zinc/25/02/70/339250270.db2.gz OAXBCGZSMCBNRY-NSHDSACASA-N 0 3 322.767 4.281 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc(F)c(F)c1 ZINC000468642836 339267769 /nfs/dbraw/zinc/26/77/69/339267769.db2.gz UKCJUWXPZGNPLP-GHXNOFRVSA-N 0 3 318.323 4.066 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1sccc1C ZINC000468644216 339267948 /nfs/dbraw/zinc/26/79/48/339267948.db2.gz YWCAMGCHRRNZGM-XYOKQWHBSA-N 0 3 302.399 4.158 20 5 DIBDHN CCS[C@@H]1CCCC[C@@H]1N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000469794232 339300517 /nfs/dbraw/zinc/30/05/17/339300517.db2.gz OHTVLQQDILGETK-DUVNUKRYSA-N 0 3 308.447 4.310 20 5 DIBDHN Cc1ccc([C@H](C)NCCc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC000481311103 339600783 /nfs/dbraw/zinc/60/07/83/339600783.db2.gz KLVCZQGPEVIOEM-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN O=[N+]([O-])c1ccc(CCN2CCC(c3ccsc3)CC2)cc1 ZINC000485999427 339718253 /nfs/dbraw/zinc/71/82/53/339718253.db2.gz CQKGUGAHJSWFQR-UHFFFAOYSA-N 0 3 316.426 4.078 20 5 DIBDHN C[C@@H](NCCCc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000492781983 339908738 /nfs/dbraw/zinc/90/87/38/339908738.db2.gz FKFQMYGPZZDKGJ-CYBMUJFWSA-N 0 3 302.349 4.017 20 5 DIBDHN CCN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000506009817 340183140 /nfs/dbraw/zinc/18/31/40/340183140.db2.gz MLFIHFXHSXSEBB-YVMONPNESA-N 0 3 302.399 4.192 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]1c1ccccc1 ZINC000506267278 340190524 /nfs/dbraw/zinc/19/05/24/340190524.db2.gz GXRDUWLWYBJCDT-QKIXSCASSA-N 0 3 308.381 4.445 20 5 DIBDHN O=[N+]([O-])c1cccc(CN(Cc2cccc3cc[nH]c32)C2CC2)c1 ZINC000507167243 340210512 /nfs/dbraw/zinc/21/05/12/340210512.db2.gz KJSOZSNFFJHUCQ-UHFFFAOYSA-N 0 3 321.380 4.241 20 5 DIBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC1CC1 ZINC000510447455 340299821 /nfs/dbraw/zinc/29/98/21/340299821.db2.gz WVFLCXKSXGWCSB-UHFFFAOYSA-N 0 3 320.776 4.350 20 5 DIBDHN CC1(C)CC[C@H](NCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000236749526 340664614 /nfs/dbraw/zinc/66/46/14/340664614.db2.gz CICCFMYLBGPJPK-SFHVURJKSA-N 0 3 310.397 4.497 20 5 DIBDHN CC[C@H](NC[C@@H](C)Oc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000539083475 340871605 /nfs/dbraw/zinc/87/16/05/340871605.db2.gz NHCKFJWXVDDJDC-KDOFPFPSSA-N 0 3 314.385 4.103 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2c3ccccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000540177986 340920804 /nfs/dbraw/zinc/92/08/04/340920804.db2.gz YLGOOIGBHGVPIL-NJSLBKSFSA-N 0 3 310.397 4.487 20 5 DIBDHN C[C@@H](NCCc1ccccc1Cl)c1ccccc1[N+](=O)[O-] ZINC000540425342 340931002 /nfs/dbraw/zinc/93/10/02/340931002.db2.gz WMNHTUIEPNQJQE-GFCCVEGCSA-N 0 3 304.777 4.142 20 5 DIBDHN O=[N+]([O-])c1ccccc1CNC[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000540610034 340938711 /nfs/dbraw/zinc/93/87/11/340938711.db2.gz JMGXXMLKUKZHRH-AAEUAGOBSA-N 0 3 316.323 4.053 20 5 DIBDHN C[C@H](Cc1ccsc1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000543058575 341029718 /nfs/dbraw/zinc/02/97/18/341029718.db2.gz VGWXJUKOMXFUPU-CYBMUJFWSA-N 0 3 316.426 4.252 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN(CCCc1ccsc1)C1CC1 ZINC000543060016 341029854 /nfs/dbraw/zinc/02/98/54/341029854.db2.gz QWUZJWWSXKTACD-UHFFFAOYSA-N 0 3 316.426 4.254 20 5 DIBDHN C[C@H](Cc1ccsc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000543986282 341065056 /nfs/dbraw/zinc/06/50/56/341065056.db2.gz OZRZLAYOXUCXAZ-CYBMUJFWSA-N 0 3 316.426 4.252 20 5 DIBDHN CC[C@@H](N[C@@H](CC)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000544833562 341095590 /nfs/dbraw/zinc/09/55/90/341095590.db2.gz WXVDKSMQDJQXFM-WCQYABFASA-N 0 3 304.312 4.367 20 5 DIBDHN CC(C)(NC/C=C\c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000545163808 341110784 /nfs/dbraw/zinc/11/07/84/341110784.db2.gz UDMRRFPEQLZCCC-ARJAWSKDSA-N 0 3 314.360 4.272 20 5 DIBDHN CC[C@@H](CC(F)(F)F)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000546165538 341155421 /nfs/dbraw/zinc/15/54/21/341155421.db2.gz CNYJMPMMAVBFST-PWSUYJOCSA-N 0 3 304.312 4.285 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000546165536 341155506 /nfs/dbraw/zinc/15/55/06/341155506.db2.gz CNYJMPMMAVBFST-CMPLNLGQSA-N 0 3 304.312 4.285 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@]1(C)CCCc2ccccc21 ZINC000546580863 341173363 /nfs/dbraw/zinc/17/33/63/341173363.db2.gz WEPFYRJYFPTXGN-LJQANCHMSA-N 0 3 310.397 4.245 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000546873235 341184603 /nfs/dbraw/zinc/18/46/03/341184603.db2.gz QYKGDHJEZNCXBA-WDEREUQCSA-N 0 3 304.312 4.285 20 5 DIBDHN CC[C@@H](CC(F)(F)F)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000546873233 341184678 /nfs/dbraw/zinc/18/46/78/341184678.db2.gz QYKGDHJEZNCXBA-MNOVXSKESA-N 0 3 304.312 4.285 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]1c1ccncc1 ZINC000564314071 341198235 /nfs/dbraw/zinc/19/82/35/341198235.db2.gz AYRZUAJKORMCCZ-QZEGLACASA-N 0 3 323.396 4.230 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cccc3cc[nH]c32)cc1[N+](=O)[O-] ZINC000237500701 341214930 /nfs/dbraw/zinc/21/49/30/341214930.db2.gz QQSSDXZMAAAEBM-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1(Cc2ccccc2)CC1 ZINC000547830696 341236083 /nfs/dbraw/zinc/23/60/83/341236083.db2.gz VPJBSBQQQLZVOJ-OAHLLOKOSA-N 0 3 310.397 4.329 20 5 DIBDHN CCN(Cc1cccc([N+](=O)[O-])c1)[C@H](C)Cc1ccsc1 ZINC000548301701 341254921 /nfs/dbraw/zinc/25/49/21/341254921.db2.gz YMBXGAKWWYOZIF-CYBMUJFWSA-N 0 3 304.415 4.109 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCCC3)o2)c(Cl)c1 ZINC000549557622 341297640 /nfs/dbraw/zinc/29/76/40/341297640.db2.gz JHIJNLKSGHGRHY-UHFFFAOYSA-N 0 3 306.749 4.104 20 5 DIBDHN CC(C)N(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1CC1 ZINC000549898242 341306174 /nfs/dbraw/zinc/30/61/74/341306174.db2.gz BFAGDOWWGXYYAJ-UHFFFAOYSA-N 0 3 316.323 4.234 20 5 DIBDHN CC(C)[C@H]1CC[C@@H]1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000552055936 341365652 /nfs/dbraw/zinc/36/56/52/341365652.db2.gz JXAQTIIMHZUCTN-KGLIPLIRSA-N 0 3 316.323 4.138 20 5 DIBDHN Cc1c([C@@H](C)N[C@@H](c2cccnc2)C2CC2)cccc1[N+](=O)[O-] ZINC000552580312 341399704 /nfs/dbraw/zinc/39/97/04/341399704.db2.gz ZOULSIOWPZOKSD-FZKQIMNGSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H]2CCc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000178087938 341944151 /nfs/dbraw/zinc/94/41/51/341944151.db2.gz MMBOMOHKWLWYLZ-SJCJKPOMSA-N 0 3 314.360 4.380 20 5 DIBDHN CCC1(NCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCCC1 ZINC000451276280 517545057 /nfs/dbraw/zinc/54/50/57/517545057.db2.gz OGZRYHGOGIHIPX-UHFFFAOYSA-N 0 3 315.373 4.062 20 5 DIBDHN CC(C)c1nc(CCN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000157011142 519861442 /nfs/dbraw/zinc/86/14/42/519861442.db2.gz FNOFVKCDHHHGCY-LBPRGKRZSA-N 0 3 319.430 4.068 20 5 DIBDHN CC[C@H](Cc1ccccc1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000610215758 1035752721 /nfs/dbraw/zinc/75/27/21/1035752721.db2.gz QEHJVDPMAYDTPL-OAHLLOKOSA-N 0 3 304.415 4.109 20 5 DIBDHN C[C@H](c1cccc(O)c1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255677318 1037240614 /nfs/dbraw/zinc/24/06/14/1037240614.db2.gz UWGSTIYXRNIHQY-DEBLGDTFSA-N 0 3 312.369 4.007 20 5 DIBDHN CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 ZINC000761250771 1037998543 /nfs/dbraw/zinc/99/85/43/1037998543.db2.gz NAJSIQJJCXUNSR-MRXNPFEDSA-N 0 3 316.788 4.368 20 5 DIBDHN CCOc1ccc([C@H](C)NCc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000152702430 1039119550 /nfs/dbraw/zinc/11/95/50/1039119550.db2.gz KTFSKMVHQWBZLV-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1ccsc1CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278279357 1039345929 /nfs/dbraw/zinc/34/59/29/1039345929.db2.gz PXBYQHJJBYHLLB-OAHLLOKOSA-N 0 3 302.399 4.132 20 5 DIBDHN CCc1cnccc1[C@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540314699 1039475518 /nfs/dbraw/zinc/47/55/18/1039475518.db2.gz VCCLSYYWVNIWCZ-KBPBESRZSA-N 0 3 313.401 4.272 20 5 DIBDHN Cc1c([C@H](C)N[C@@H]2CCc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000089552416 1039786504 /nfs/dbraw/zinc/78/65/04/1039786504.db2.gz YNMYTORDCVGYFW-YVEFUNNKSA-N 0 3 314.360 4.380 20 5 DIBDHN C[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000609147441 1039818302 /nfs/dbraw/zinc/81/83/02/1039818302.db2.gz UPUZOLAPJNSTLH-XJKCOSOUSA-N 0 3 306.381 4.135 20 5 DIBDHN CC(C)(NC/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000492371713 1039957360 /nfs/dbraw/zinc/95/73/60/1039957360.db2.gz ABQBJJODFNDOIN-VQHVLOKHSA-N 0 3 314.360 4.272 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000172831451 1040857538 /nfs/dbraw/zinc/85/75/38/1040857538.db2.gz OVYWJCCNEVHARN-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN CCC[C@@H](NCc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120162084 1041360392 /nfs/dbraw/zinc/36/03/92/1041360392.db2.gz KYAGWXKKSSZRLY-QGZVFWFLSA-N 0 3 302.349 4.365 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cc(C)c(O)c(C)c2)cc1[N+](=O)[O-] ZINC000290302497 1041433391 /nfs/dbraw/zinc/43/33/91/1041433391.db2.gz IAHLCSNMQZYCRR-AWEZNQCLSA-N 0 3 314.385 4.076 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000053148117 1041443441 /nfs/dbraw/zinc/44/34/41/1041443441.db2.gz CSLHWFNJWKGLSE-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1cccs1)CCCC2 ZINC000417328374 1041656690 /nfs/dbraw/zinc/65/66/90/1041656690.db2.gz SMAKZIJBXBHYDW-MRXNPFEDSA-N 0 3 302.399 4.214 20 5 DIBDHN C[C@H](CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433239094 1042461303 /nfs/dbraw/zinc/46/13/03/1042461303.db2.gz JAFOLIIEFPWXFP-NOZJJQNGSA-N 0 3 316.323 4.105 20 5 DIBDHN CCC[C@@H](NCc1cc(C)cc(N)c1)c1cccc([N+](=O)[O-])c1 ZINC000423478284 1042714823 /nfs/dbraw/zinc/71/48/23/1042714823.db2.gz LAFNRYZONXJIBD-GOSISDBHSA-N 0 3 313.401 4.116 20 5 DIBDHN Cc1ccccc1C[C@@H]1CCCN1Cc1csc([N+](=O)[O-])c1 ZINC000514179451 1042772906 /nfs/dbraw/zinc/77/29/06/1042772906.db2.gz RINLENKFTVJMBV-INIZCTEOSA-N 0 3 316.426 4.172 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1C(C)C ZINC000517094435 1042866902 /nfs/dbraw/zinc/86/69/02/1042866902.db2.gz UMNUPJNDVPLSCY-MRXNPFEDSA-N 0 3 306.406 4.002 20 5 DIBDHN Cc1ccc(CN[C@@H](c2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000108423119 1042911355 /nfs/dbraw/zinc/91/13/55/1042911355.db2.gz AXNXCSARCXHTIE-GOSISDBHSA-N 0 3 314.360 4.283 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCCc2sccc21 ZINC000183784341 1043171297 /nfs/dbraw/zinc/17/12/97/1043171297.db2.gz DJJRREZBUVMNQC-OAHLLOKOSA-N 0 3 302.399 4.132 20 5 DIBDHN Cc1ccc(CN[C@H](CC(C)C)c2ccncc2)cc1[N+](=O)[O-] ZINC000866540921 1043220205 /nfs/dbraw/zinc/22/02/05/1043220205.db2.gz TXDNSOFKCRJWBQ-QGZVFWFLSA-N 0 3 313.401 4.175 20 5 DIBDHN Cc1ccc(CN[C@@H](CC(C)C)c2ccncc2)cc1[N+](=O)[O-] ZINC000866540920 1043220962 /nfs/dbraw/zinc/22/09/62/1043220962.db2.gz TXDNSOFKCRJWBQ-KRWDZBQOSA-N 0 3 313.401 4.175 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000268860897 1043338302 /nfs/dbraw/zinc/33/83/02/1043338302.db2.gz BUZZBJDADMLQIT-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000269023791 1043353258 /nfs/dbraw/zinc/35/32/58/1043353258.db2.gz QHALGRYLHUEWTN-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](C)CC(F)(F)F ZINC000872064272 1043446393 /nfs/dbraw/zinc/44/63/93/1043446393.db2.gz XPQDEHFBHWGLNR-DTWKUNHWSA-N 0 3 322.352 4.308 20 5 DIBDHN CC[C@H](c1ccncc1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000565450836 1044436924 /nfs/dbraw/zinc/43/69/24/1044436924.db2.gz OVZPKGKQSCMJGH-BQLWYNFJSA-N 0 3 311.385 4.086 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccc(Cl)cc1 ZINC000567291268 1044557084 /nfs/dbraw/zinc/55/70/84/1044557084.db2.gz WDDAZUNVJWRLTL-OAHLLOKOSA-N 0 3 302.761 4.025 20 5 DIBDHN O=[N+]([O-])c1cccc([C@@H](NCCc2ccco2)c2ccccc2)c1 ZINC000156234092 1044781858 /nfs/dbraw/zinc/78/18/58/1044781858.db2.gz WGUAYEYBDAAFBA-IBGZPJMESA-N 0 3 322.364 4.110 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000447545747 1045143780 /nfs/dbraw/zinc/14/37/80/1045143780.db2.gz ZCHADHIMRLGPQA-LJQANCHMSA-N 0 3 310.397 4.379 20 5 DIBDHN CCc1ccccc1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447545093 1045144687 /nfs/dbraw/zinc/14/46/87/1045144687.db2.gz XAPUQHYZZSODHS-IBGZPJMESA-N 0 3 310.397 4.324 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H]2CCCc3ncccc32)cc1[N+](=O)[O-] ZINC000601271829 1045209212 /nfs/dbraw/zinc/20/92/12/1045209212.db2.gz UXBAUTCSUQESPQ-CXAGYDPISA-N 0 3 311.385 4.026 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](c2ccccc2F)C1 ZINC000578120850 1045210599 /nfs/dbraw/zinc/21/05/99/1045210599.db2.gz KTMUDNLXNILFBQ-KGLIPLIRSA-N 0 3 314.360 4.284 20 5 DIBDHN C[C@@H](N[C@@H]1CCCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000089214366 1045614422 /nfs/dbraw/zinc/61/44/22/1045614422.db2.gz DZNUZUHZUOTFQP-KZULUSFZSA-N 0 3 314.360 4.462 20 5 DIBDHN COCC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000451101021 1045628433 /nfs/dbraw/zinc/62/84/33/1045628433.db2.gz ABQUAUUSZGCOMG-KSSFIOAISA-N 0 3 314.385 4.023 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc2ncccc2c1 ZINC000530365704 1045652989 /nfs/dbraw/zinc/65/29/89/1045652989.db2.gz ANIICZZKWGFSFP-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CN(Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCCc2ccccc21 ZINC000801508984 1045725372 /nfs/dbraw/zinc/72/53/72/1045725372.db2.gz KLTCNBCHKXLILS-QGZVFWFLSA-N 0 3 314.360 4.243 20 5 DIBDHN CC[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(C)cc1 ZINC000801526805 1045731006 /nfs/dbraw/zinc/73/10/06/1045731006.db2.gz XTDBXEXACRIXCK-INIZCTEOSA-N 0 3 302.349 4.283 20 5 DIBDHN Cc1cccc([C@@H]2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)C2)c1 ZINC000801539425 1045733444 /nfs/dbraw/zinc/73/34/44/1045733444.db2.gz GLBHKZCWQVIAOX-MRXNPFEDSA-N 0 3 314.360 4.032 20 5 DIBDHN CC(C)(C)SCCN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000801929559 1045848351 /nfs/dbraw/zinc/84/83/51/1045848351.db2.gz PUZMAUONLUGOTD-UHFFFAOYSA-N 0 3 308.447 4.091 20 5 DIBDHN Cc1[nH]c2c(cc(C)cc2CNCc2cccc([N+](=O)[O-])c2)c1C ZINC000520214318 1045892975 /nfs/dbraw/zinc/89/29/75/1045892975.db2.gz UUPHDYHOSPLESE-UHFFFAOYSA-N 0 3 323.396 4.291 20 5 DIBDHN CCOc1cc(CN[C@H](C)c2ccc(C)s2)ccc1[N+](=O)[O-] ZINC000755048758 1045949378 /nfs/dbraw/zinc/94/93/78/1045949378.db2.gz PUEIBMIPOUKSKR-GFCCVEGCSA-N 0 3 320.414 4.214 20 5 DIBDHN CC(C)(NC[C@]1(C)CC1(Cl)Cl)c1ccccc1[N+](=O)[O-] ZINC000830009100 1046029659 /nfs/dbraw/zinc/02/96/59/1046029659.db2.gz PVJGRCROEMXPEY-ZDUSSCGKSA-N 0 3 317.216 4.003 20 5 DIBDHN Cc1ccc([C@@H](C)N2CCC[C@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000453356648 1046055777 /nfs/dbraw/zinc/05/57/77/1046055777.db2.gz LAONBXDDAGEKMZ-PBHICJAKSA-N 0 3 320.458 4.183 20 5 DIBDHN COc1cc([C@H](C)N[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000903056594 1046151374 /nfs/dbraw/zinc/15/13/74/1046151374.db2.gz WFJNHOYVAWYIGY-OLZOCXBDSA-N 0 3 300.358 4.015 20 5 DIBDHN CC[C@@H](N[C@@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903426915 1046275123 /nfs/dbraw/zinc/27/51/23/1046275123.db2.gz CMOJPGHQPHQZLN-QZTJIDSGSA-N 0 3 311.385 4.182 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](c1ccncc1)C1CC1 ZINC000903430058 1046278642 /nfs/dbraw/zinc/27/86/42/1046278642.db2.gz XJCXSUCWKMNNKL-SCLBCKFNSA-N 0 3 311.385 4.100 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2nc(CN3CCCCCCC3)co2)cc1 ZINC000089882818 1046322787 /nfs/dbraw/zinc/32/27/87/1046322787.db2.gz WSAKGORGRUTCAR-UHFFFAOYSA-N 0 3 315.373 4.016 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)cc1CN[C@H]1C[C@H](c2ccccc2)C1 ZINC000797876390 1046900225 /nfs/dbraw/zinc/90/02/25/1046900225.db2.gz HROPYCFRUXHQML-SAZUREKKSA-N 0 3 316.788 4.284 20 5 DIBDHN CCc1cnccc1[C@@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000538113256 1047658545 /nfs/dbraw/zinc/65/85/45/1047658545.db2.gz BRYGBKFWLFEDOQ-ZIAGYGMSSA-N 0 3 313.401 4.272 20 5 DIBDHN C[C@@H](N[C@H]1CCSC2(CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000927035434 1047764755 /nfs/dbraw/zinc/76/47/55/1047764755.db2.gz GPIRTKRTLCGXMF-NEPJUHHUSA-N 0 3 324.421 4.203 20 5 DIBDHN Cc1ccccc1C1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000553085632 1047820221 /nfs/dbraw/zinc/82/02/21/1047820221.db2.gz QNBWCJFSIPACPL-UHFFFAOYSA-N 0 3 310.397 4.283 20 5 DIBDHN Cc1ccc2cc(CN[C@@H](C)c3ccc([N+](=O)[O-])cc3)ccc2n1 ZINC001183788952 1047966445 /nfs/dbraw/zinc/96/64/45/1047966445.db2.gz QCBJBROVKKNQPF-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CCC[C@H](N)C(=O)N(C)Cc1c2ccccc2cc2ccccc21 ZINC001160735158 1048080911 /nfs/dbraw/zinc/08/09/11/1048080911.db2.gz OYPYVRRCAWATGJ-FQEVSTJZSA-N 0 3 320.436 4.079 20 5 DIBDHN Cn1nccc1CNCc1c2ccccc2cc2ccccc21 ZINC000030906579 1048168725 /nfs/dbraw/zinc/16/87/25/1048168725.db2.gz BFWRGHNDXOKFAM-UHFFFAOYSA-N 0 3 301.393 4.016 20 5 DIBDHN O=[N+]([O-])c1ccsc1NCCN1CCC2(CCCCC2)CC1 ZINC001186248606 1048275528 /nfs/dbraw/zinc/27/55/28/1048275528.db2.gz LOJNQBGUSKMPNI-UHFFFAOYSA-N 0 3 323.462 4.115 20 5 DIBDHN CN1CCC=C(Nc2c(N)c3ccccc3c3ccccc32)C1 ZINC001175577629 1048376057 /nfs/dbraw/zinc/37/60/57/1048376057.db2.gz FKLUCTYXRYSTME-UHFFFAOYSA-N 0 3 303.409 4.207 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC001177328991 1048871534 /nfs/dbraw/zinc/87/15/34/1048871534.db2.gz YPQYVSOIAXDHKU-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN CCOc1cccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173364210 1049139067 /nfs/dbraw/zinc/13/90/67/1049139067.db2.gz RHTZSIOSHMDZEP-KBPBESRZSA-N 0 3 314.385 4.405 20 5 DIBDHN CCc1ccccc1CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001192930075 1049155206 /nfs/dbraw/zinc/15/52/06/1049155206.db2.gz SFPVIYDPINNCEL-UHFFFAOYSA-N 0 3 310.397 4.322 20 5 DIBDHN C[C@@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC001204498092 1049175748 /nfs/dbraw/zinc/17/57/48/1049175748.db2.gz XETNPKTVUUDDOL-LLVKDONJSA-N 0 3 316.323 4.236 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN(Cc1ccccc1)C1CC1 ZINC001179905532 1049238572 /nfs/dbraw/zinc/23/85/72/1049238572.db2.gz KNRAZXZQFBMDGR-UHFFFAOYSA-N 0 3 310.397 4.376 20 5 DIBDHN CCC[C@H](NCc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC001194425158 1049372507 /nfs/dbraw/zinc/37/25/07/1049372507.db2.gz ABVQEZSFYZMEFD-AWEZNQCLSA-N 0 3 300.349 4.177 20 5 DIBDHN CC(C)(NC/C=C\c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001205290819 1049429631 /nfs/dbraw/zinc/42/96/31/1049429631.db2.gz BXOWZONTWYVLHQ-XQRVVYSFSA-N 0 3 314.360 4.272 20 5 DIBDHN CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC(C)(C)C1 ZINC001195002401 1049460769 /nfs/dbraw/zinc/46/07/69/1049460769.db2.gz BCTAKBIYUIEPDB-UHFFFAOYSA-N 0 3 316.323 4.234 20 5 DIBDHN O=[N+]([O-])c1cc(CN2CCCC[C@@H]2C2CCC2)ccc1Cl ZINC001195825396 1049577044 /nfs/dbraw/zinc/57/70/44/1049577044.db2.gz IXYYJVATZMGOKI-OAHLLOKOSA-N 0 3 308.809 4.403 20 5 DIBDHN O=[N+]([O-])c1cc(CN2CCCC[C@H]2C2CCC2)ccc1Cl ZINC001195825394 1049577521 /nfs/dbraw/zinc/57/75/21/1049577521.db2.gz IXYYJVATZMGOKI-HNNXBMFYSA-N 0 3 308.809 4.403 20 5 DIBDHN O=[N+]([O-])c1ccc(CNCc2cccc3cc[nH]c32)cc1Cl ZINC000786580089 1050498503 /nfs/dbraw/zinc/49/85/03/1050498503.db2.gz XRHDJFGWPTUWSQ-UHFFFAOYSA-N 0 3 315.760 4.019 20 5 DIBDHN CSc1ccc(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000594505316 1050521792 /nfs/dbraw/zinc/52/17/92/1050521792.db2.gz QJVZZENAIQSXPN-MRXNPFEDSA-N 0 3 314.410 4.094 20 5 DIBDHN C[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC001168405683 1050555257 /nfs/dbraw/zinc/55/52/57/1050555257.db2.gz ZPWQNYAIEYLEGB-KCPJHIHWSA-N 0 3 308.809 4.259 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CCc3ccccc31)CCC2 ZINC000595076301 1050606842 /nfs/dbraw/zinc/60/68/42/1050606842.db2.gz HXJPFVYXYCHWTB-RTBURBONSA-N 0 3 308.381 4.249 20 5 DIBDHN COc1cccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000595107183 1050606859 /nfs/dbraw/zinc/60/68/59/1050606859.db2.gz WJHXDEKZWTWGHN-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN CCC(C)(C)[C@@H](C)NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000595642698 1050657532 /nfs/dbraw/zinc/65/75/32/1050657532.db2.gz QULNVSALLIYFML-GFCCVEGCSA-N 0 3 317.389 4.164 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@]2(CC2(F)F)C1 ZINC000846105059 1050672632 /nfs/dbraw/zinc/67/26/32/1050672632.db2.gz POBGKBOUKSNSOA-RQPMMQJISA-N 0 3 322.355 4.119 20 5 DIBDHN Cc1cc(C)cc([C@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788596679 1050710494 /nfs/dbraw/zinc/71/04/94/1050710494.db2.gz ZZKQMQZAPHZJFQ-KGLIPLIRSA-N 0 3 313.401 4.206 20 5 DIBDHN Cc1cc([C@@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)s1 ZINC000788693310 1050728100 /nfs/dbraw/zinc/72/81/00/1050728100.db2.gz RSJQIJXGLHCMAH-WDEREUQCSA-N 0 3 319.430 4.267 20 5 DIBDHN C[C@@H](CSC(C)(C)C)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000773038015 1051034141 /nfs/dbraw/zinc/03/41/41/1051034141.db2.gz YWDRPFUFEFWOHF-JTQLQIEISA-N 0 3 316.854 4.258 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CCC(C)(C)C ZINC001171523452 1051159641 /nfs/dbraw/zinc/15/96/41/1051159641.db2.gz OLJAEFVRQQIFAK-UHFFFAOYSA-N 0 3 308.422 4.250 20 5 DIBDHN CC(C)=CCC/C(C)=C/CNc1cc2c(cc1[N+](=O)[O-])CNC2 ZINC001169138637 1051529569 /nfs/dbraw/zinc/52/95/69/1051529569.db2.gz RPZRKXJWQVHUDI-VGOFMYFVSA-N 0 3 315.417 4.303 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC/C=C/c2ccccc2)cc1Cl ZINC000761531734 1051589524 /nfs/dbraw/zinc/58/95/24/1051589524.db2.gz JPRLWRIQIIJVGV-QPJJXVBHSA-N 0 3 302.761 4.051 20 5 DIBDHN Cc1cc2cc3cc(C)c(Nc4cn[nH]c4)cc3nc2cc1N ZINC001174297302 1052075879 /nfs/dbraw/zinc/07/58/79/1052075879.db2.gz PPKRHUOBDGMJDJ-UHFFFAOYSA-N 0 3 303.369 4.054 20 5 DIBDHN Cc1cc2cc3cc(C)c(Nc4cncnc4)cc3nc2cc1N ZINC001174389190 1052146602 /nfs/dbraw/zinc/14/66/02/1052146602.db2.gz MBWASNKCLIYKDV-UHFFFAOYSA-N 0 3 315.380 4.121 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CNCc1ccc(C2CCC2)cc1 ZINC000494841950 1052147600 /nfs/dbraw/zinc/14/76/00/1052147600.db2.gz JGLQRMGZIDLPDE-UHFFFAOYSA-N 0 3 310.397 4.461 20 5 DIBDHN CCc1ccc([C@@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000495427236 1052344826 /nfs/dbraw/zinc/34/48/26/1052344826.db2.gz QKJQLSNPEJCJHN-LLVKDONJSA-N 0 3 322.792 4.297 20 5 DIBDHN C[C@@H]1CCN(Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000917053299 1052683125 /nfs/dbraw/zinc/68/31/25/1052683125.db2.gz ZQGBXLLNFLWDNH-ISTRZQFTSA-N 0 3 306.381 4.135 20 5 DIBDHN C[C@@H]1CCN(Cc2cc(F)ccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000917053302 1052683538 /nfs/dbraw/zinc/68/35/38/1052683538.db2.gz ZQGBXLLNFLWDNH-VMGRFDJRSA-N 0 3 306.381 4.135 20 5 DIBDHN Cc1c([C@@H](C)NCc2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC001319768316 1053271940 /nfs/dbraw/zinc/27/19/40/1053271940.db2.gz XJWLVCJGZDKWKC-CQSZACIVSA-N 0 3 310.397 4.243 20 5 DIBDHN CC(C)N(CCc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC001320747933 1053358751 /nfs/dbraw/zinc/35/87/51/1053358751.db2.gz CXEGMOZSSVKJAR-UHFFFAOYSA-N 0 3 316.376 4.187 20 5 DIBDHN C[C@H](N[C@H]1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC000081181376 1053991640 /nfs/dbraw/zinc/99/16/40/1053991640.db2.gz DLRNCIRPOHFQBB-GTNSWQLSSA-N 0 3 300.333 4.072 20 5 DIBDHN CSc1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC001200811797 1053997547 /nfs/dbraw/zinc/99/75/47/1053997547.db2.gz HFJFVEPUTIFWJK-ZDUSSCGKSA-N 0 3 316.426 4.476 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000848526946 1054126496 /nfs/dbraw/zinc/12/64/96/1054126496.db2.gz MNWJLWLKAKDJPH-RISCZKNCSA-N 0 3 302.399 4.303 20 5 DIBDHN CC[C@H](N[C@@H](C)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090918676 1054738008 /nfs/dbraw/zinc/73/80/08/1054738008.db2.gz NIIZEYBHDKIYBT-UGSOOPFHSA-N 0 3 314.385 4.405 20 5 DIBDHN CC[C@H](N[C@@H](C)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000090918543 1054739094 /nfs/dbraw/zinc/73/90/94/1054739094.db2.gz CAFZSWVLEJLNOE-UGSOOPFHSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC001168553537 1055569085 /nfs/dbraw/zinc/56/90/85/1055569085.db2.gz UBVCTQQJEQHYEN-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)cc1CNCCSc1ccccc1 ZINC000084439772 1056000264 /nfs/dbraw/zinc/00/02/64/1056000264.db2.gz MGPFQBQSYVTKJH-UHFFFAOYSA-N 0 3 322.817 4.130 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000090964128 1056123635 /nfs/dbraw/zinc/12/36/35/1056123635.db2.gz NZFMMCXMVMHULQ-KPZWWZAWSA-N 0 3 314.360 4.462 20 5 DIBDHN CCOc1ccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000078995824 1056901070 /nfs/dbraw/zinc/90/10/70/1056901070.db2.gz XXRGGTYLRNRFAR-ZIAGYGMSSA-N 0 3 314.385 4.405 20 5 DIBDHN c1ccc2c(c1)cc(-c1cc3c(nn1)CCNC3)c1ccccc21 ZINC001241131896 1056914214 /nfs/dbraw/zinc/91/42/14/1056914214.db2.gz HDMOYBMEPDXROP-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN C[C@@H](c1cccc(O)c1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093315360 1057036482 /nfs/dbraw/zinc/03/64/82/1057036482.db2.gz UWGSTIYXRNIHQY-MRZGDXHCSA-N 0 3 312.369 4.007 20 5 DIBDHN CC(C)(C)c1ccc(CNCc2ccc([N+](=O)[O-])cc2)s1 ZINC000126618151 1057097379 /nfs/dbraw/zinc/09/73/79/1057097379.db2.gz ZCWUBUITTITSAY-UHFFFAOYSA-N 0 3 304.415 4.244 20 5 DIBDHN CCC[C@H](N[C@@H](C)c1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000611299972 1057590917 /nfs/dbraw/zinc/59/09/17/1057590917.db2.gz UGRCVQHPUHWAHH-KSSFIOAISA-N 0 3 313.401 4.490 20 5 DIBDHN Cc1ccccc1[C@@H](NCc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000732819870 1057788008 /nfs/dbraw/zinc/78/80/08/1057788008.db2.gz BTAYFAIWZXAOSD-IBGZPJMESA-N 0 3 310.397 4.453 20 5 DIBDHN C[C@H]1CCC[C@H](CCN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001559595112 1059429260 /nfs/dbraw/zinc/42/92/60/1059429260.db2.gz YSZIULCOKWAMOO-LSDHHAIUSA-N 0 3 302.418 4.169 20 5 DIBDHN Cc1ccc(C2(NCc3cccc([N+](=O)[O-])c3C)CCC2)cc1 ZINC001559966566 1059773026 /nfs/dbraw/zinc/77/30/26/1059773026.db2.gz DTOMGMXYXSIVNT-UHFFFAOYSA-N 0 3 310.397 4.381 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(c2ccco2)CC1 ZINC001559982052 1059788135 /nfs/dbraw/zinc/78/81/35/1059788135.db2.gz GZBIGRVWZFCIGD-CQSZACIVSA-N 0 3 314.385 4.437 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN(C)C[C@H](C)C1CCCCC1 ZINC001560058114 1059874874 /nfs/dbraw/zinc/87/48/74/1059874874.db2.gz KYKGXVBACHCIGM-AWEZNQCLSA-N 0 3 320.433 4.252 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc3[nH]ccc3c2)cc1[N+](=O)[O-] ZINC001560357057 1060142959 /nfs/dbraw/zinc/14/29/59/1060142959.db2.gz DEQYWELPVNDRPW-CYBMUJFWSA-N 0 3 309.369 4.235 20 5 DIBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@@H]1C1CCCCC1 ZINC001560359200 1060146197 /nfs/dbraw/zinc/14/61/97/1060146197.db2.gz FEKGEMHQJCCZNQ-IAGOWNOFSA-N 0 3 318.417 4.052 20 5 DIBDHN CC[C@H]1CCC[C@@H](CN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001560697980 1060549028 /nfs/dbraw/zinc/54/90/28/1060549028.db2.gz WSDHJOFHVAEBDZ-LSDHHAIUSA-N 0 3 302.418 4.169 20 5 DIBDHN C[C@@H]1C[C@@H](C)CN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001560715444 1060572930 /nfs/dbraw/zinc/57/29/30/1060572930.db2.gz IKYAFKPDDIMSFZ-GHMZBOCLSA-N 0 3 316.323 4.092 20 5 DIBDHN C[C@@H](CC1CCCCC1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001560799289 1060661722 /nfs/dbraw/zinc/66/17/22/1060661722.db2.gz AMSICHQBRSPGHS-LBPRGKRZSA-N 0 3 317.389 4.185 20 5 DIBDHN CCC(F)(F)C(C)(C)CNCc1ccc([N+](=O)[O-])cc1Cl ZINC001560967342 1060833652 /nfs/dbraw/zinc/83/36/52/1060833652.db2.gz DVPJAHDVLCBWBO-UHFFFAOYSA-N 0 3 320.767 4.409 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(F)(C2CC2)CC1 ZINC001561033035 1060886692 /nfs/dbraw/zinc/88/66/92/1060886692.db2.gz AMLQKOIGQGGRGW-KAMYIIQDSA-N 0 3 318.392 4.212 20 5 DIBDHN CCC1(CC)CN(Cc2cccc([N+](=O)[O-])c2C)CCS1 ZINC001473360341 1061111756 /nfs/dbraw/zinc/11/17/56/1061111756.db2.gz JTXBEQIIWJGQLT-UHFFFAOYSA-N 0 3 308.447 4.011 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCC[C@@H]1CC1CCC1 ZINC001473662414 1061323366 /nfs/dbraw/zinc/32/33/66/1061323366.db2.gz BJENOMTYVRFKOT-MRXNPFEDSA-N 0 3 306.381 4.279 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@H]1CC1CCC1 ZINC001473663683 1061325385 /nfs/dbraw/zinc/32/53/85/1061325385.db2.gz MELJNANPEAJAHE-INIZCTEOSA-N 0 3 318.417 4.148 20 5 DIBDHN C[C@@H](NCc1ccc2c(c1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC001474265931 1061833792 /nfs/dbraw/zinc/83/37/92/1061833792.db2.gz ICISMIOFILBRPO-CQSZACIVSA-N 0 3 310.397 4.324 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)Cc1ccc(F)cc1 ZINC001474414965 1062084746 /nfs/dbraw/zinc/08/47/46/1062084746.db2.gz JMEAHWPDSSLNPO-GXDHUFHOSA-N 0 3 314.360 4.269 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN(C)CCC1CCCCC1 ZINC001459404158 1062130879 /nfs/dbraw/zinc/13/08/79/1062130879.db2.gz INLBENOIRWNLBN-UHFFFAOYSA-N 0 3 306.406 4.006 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1cccc(Cl)c1F ZINC001254536826 1062163978 /nfs/dbraw/zinc/16/39/78/1062163978.db2.gz UHUPOVDTGIRHAQ-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN CCCCO[C@@H]1C[C@H](N[C@H](C)c2ccccc2[N+](=O)[O-])C1(C)C ZINC001460075052 1062617765 /nfs/dbraw/zinc/61/77/65/1062617765.db2.gz MNYBZKGAZHHRMF-XOKHGSTOSA-N 0 3 320.433 4.229 20 5 DIBDHN CC1(C)CCC[C@H]1[C@H]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001460295339 1062765322 /nfs/dbraw/zinc/76/53/22/1062765322.db2.gz IKKMDUDRZFVEOY-BBRMVZONSA-N 0 3 320.408 4.382 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CC[C@@H](C3CCCCC3)C2)c(F)c1 ZINC001460372252 1062819932 /nfs/dbraw/zinc/81/99/32/1062819932.db2.gz YPEGHKFRNXVVAC-CQSZACIVSA-N 0 3 306.381 4.136 20 5 DIBDHN CC[C@@H]1CC[C@@H](C)N(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001460446433 1062862466 /nfs/dbraw/zinc/86/24/66/1062862466.db2.gz UAVBAZVIYTYAKF-HUUCEWRRSA-N 0 3 320.433 4.393 20 5 DIBDHN Cc1ccc(CN[C@H](C)c2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC001460742107 1063033662 /nfs/dbraw/zinc/03/36/62/1063033662.db2.gz AXPQMVMFCCYWTB-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN CC[C@H](C)[C@H]1CCCCN1Cc1cc([N+](=O)[O-])ccc1OC ZINC001473178528 1063485795 /nfs/dbraw/zinc/48/57/95/1063485795.db2.gz HQFFQNODCFESGM-XJKSGUPXSA-N 0 3 306.406 4.004 20 5 DIBDHN C[C@H](N[C@H]1CS[C@@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000488442125 1063905976 /nfs/dbraw/zinc/90/59/76/1063905976.db2.gz MKKVRROJAXHFKK-YWPYICTPSA-N 0 3 308.447 4.166 20 5 DIBDHN CC[C@@H]1Cc2ccccc2CN1Cc1cccc([N+](=O)[O-])c1C ZINC001307658498 1065546502 /nfs/dbraw/zinc/54/65/02/1065546502.db2.gz BDOVJFZHORCNKJ-GOSISDBHSA-N 0 3 310.397 4.240 20 5 DIBDHN C[C@@H]1CC(C)(C)CC[C@@H]1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC001307704623 1065575581 /nfs/dbraw/zinc/57/55/81/1065575581.db2.gz DKYQOMAVLVENCP-BMIGLBTASA-N 0 3 312.360 4.177 20 5 DIBDHN Cc1cccc2[nH]c(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)cc21 ZINC001308207562 1065814172 /nfs/dbraw/zinc/81/41/72/1065814172.db2.gz DXQDORUWTAIVNT-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN Cc1cccc2[nH]c(CN[C@H](C)c3cccc([N+](=O)[O-])c3)cc21 ZINC001308207561 1065814374 /nfs/dbraw/zinc/81/43/74/1065814374.db2.gz DXQDORUWTAIVNT-CYBMUJFWSA-N 0 3 309.369 4.235 20 5 DIBDHN O=[N+]([O-])c1ccc(CNCCCc2cccc(Cl)c2)c(F)c1 ZINC001308733080 1066209931 /nfs/dbraw/zinc/20/99/31/1066209931.db2.gz WPCLPCZVRWIWFF-UHFFFAOYSA-N 0 3 322.767 4.110 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2C2CCC2)cc1Cl ZINC001308852106 1066328709 /nfs/dbraw/zinc/32/87/09/1066328709.db2.gz VFFAIBXPOHZLCU-OAHLLOKOSA-N 0 3 308.809 4.403 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CC([C@@H]2CCC[C@H](C)C2)C1 ZINC001308911073 1066390758 /nfs/dbraw/zinc/39/07/58/1066390758.db2.gz DAEVDCFIUFAKJI-XJKSGUPXSA-N 0 3 316.445 4.470 20 5 DIBDHN CSCc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000284946867 131125647 /nfs/dbraw/zinc/12/56/47/131125647.db2.gz BOOCCTHQMKRMMW-ZDUSSCGKSA-N 0 3 316.426 4.309 20 5 DIBDHN CSCc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000285720724 131196577 /nfs/dbraw/zinc/19/65/77/131196577.db2.gz QFADSKGMZBNGRW-ZDUSSCGKSA-N 0 3 316.426 4.309 20 5 DIBDHN CC[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000035055418 331467623 /nfs/dbraw/zinc/46/76/23/331467623.db2.gz SOQQIAJPHOZGNZ-MRXNPFEDSA-N 0 3 304.777 4.489 20 5 DIBDHN Cc1ccc(CN2CC[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000560542546 332355686 /nfs/dbraw/zinc/35/56/86/332355686.db2.gz PCTFNARQUICVJP-HNNXBMFYSA-N 0 3 314.360 4.032 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000111158731 333059743 /nfs/dbraw/zinc/05/97/43/333059743.db2.gz NSPPLQHOKKXIOK-INIZCTEOSA-N 0 3 302.761 4.025 20 5 DIBDHN O=[N+]([O-])c1cccc(CN[C@H]2CCc3cc(Cl)ccc32)c1 ZINC000111158723 333059771 /nfs/dbraw/zinc/05/97/71/333059771.db2.gz GSZNSOQLXLCAPO-INIZCTEOSA-N 0 3 302.761 4.025 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1cscc1C ZINC000487166966 333115271 /nfs/dbraw/zinc/11/52/71/333115271.db2.gz HIYUHNCSVFYCHD-WUXMJOGZSA-N 0 3 302.399 4.158 20 5 DIBDHN Cc1c(CN[C@@H]2CCc3cc(Cl)ccc32)cccc1[N+](=O)[O-] ZINC000318666661 333200585 /nfs/dbraw/zinc/20/05/85/333200585.db2.gz YSNCUIWXLSBLBV-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN Cc1ccc(CNCc2ccc(C(F)F)cc2)cc1[N+](=O)[O-] ZINC000185187060 333205304 /nfs/dbraw/zinc/20/53/04/333205304.db2.gz WDCXRWFHDNLSSF-UHFFFAOYSA-N 0 3 306.312 4.131 20 5 DIBDHN Cc1c(CN[C@@H]2CCSc3ccccc32)cccc1[N+](=O)[O-] ZINC000319174610 333269320 /nfs/dbraw/zinc/26/93/20/333269320.db2.gz JJYRXSMSNGUFFX-OAHLLOKOSA-N 0 3 314.410 4.230 20 5 DIBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000531202364 333330706 /nfs/dbraw/zinc/33/07/06/333330706.db2.gz ULQRNEXDGQSTCL-DOMZBBRYSA-N 0 3 302.399 4.034 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000414119552 333906479 /nfs/dbraw/zinc/90/64/79/333906479.db2.gz DDYIXTLUVNSQPO-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H](c1ccccc1)C1CC1 ZINC000571656032 334075034 /nfs/dbraw/zinc/07/50/34/334075034.db2.gz YMDWLYFYAJEJTH-PKOBYXMFSA-N 0 3 308.381 4.323 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H](c1ccccc1)C1CC1 ZINC000571656028 334075142 /nfs/dbraw/zinc/07/51/42/334075142.db2.gz YMDWLYFYAJEJTH-IEBWSBKVSA-N 0 3 308.381 4.323 20 5 DIBDHN CC[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000534696729 334327820 /nfs/dbraw/zinc/32/78/20/334327820.db2.gz OYLHGUJCPAOOIY-QGZVFWFLSA-N 0 3 320.339 4.156 20 5 DIBDHN Cc1cccc2c1OCC[C@@H]2NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000188945830 337276701 /nfs/dbraw/zinc/27/67/01/337276701.db2.gz ZGYZRUUUAZVCOY-JZLODUJNSA-N 0 3 324.380 4.030 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H](C)Oc1ccccc1 ZINC000536873073 337758374 /nfs/dbraw/zinc/75/83/74/337758374.db2.gz WBEYGLCQINPVJG-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1F ZINC000120901527 337883010 /nfs/dbraw/zinc/88/30/10/337883010.db2.gz ZMGOOTKNAIASHF-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN Cc1c(CN(CCC(F)(F)F)CC2CC2)cccc1[N+](=O)[O-] ZINC000084138297 338000291 /nfs/dbraw/zinc/00/02/91/338000291.db2.gz RTPUPMXQPQNJMN-UHFFFAOYSA-N 0 3 316.323 4.068 20 5 DIBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1occc1C ZINC000426340308 338027881 /nfs/dbraw/zinc/02/78/81/338027881.db2.gz ZQFQQBRBXCFCAB-CYBMUJFWSA-N 0 3 320.414 4.157 20 5 DIBDHN CSC[C@@H]1CCCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000430200283 338101058 /nfs/dbraw/zinc/10/10/58/338101058.db2.gz UGCCMBJFTYATOY-IHWMJMDHSA-N 0 3 320.458 4.073 20 5 DIBDHN Cc1ccc(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000433160699 338183527 /nfs/dbraw/zinc/18/35/27/338183527.db2.gz HYNLGPBGPCSOTL-SFHVURJKSA-N 0 3 310.397 4.415 20 5 DIBDHN C[C@H](CC(F)(F)F)N[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433239448 338187419 /nfs/dbraw/zinc/18/74/19/338187419.db2.gz GUTKXOSQVXBEET-RNCFNFMXSA-N 0 3 316.323 4.248 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447609982 338561997 /nfs/dbraw/zinc/56/19/97/338561997.db2.gz ZVIRAIHMXPMEPC-RISCZKNCSA-N 0 3 316.323 4.293 20 5 DIBDHN Cc1ccc(F)c(CNCCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000462769940 339087752 /nfs/dbraw/zinc/08/77/52/339087752.db2.gz VFLSQJHXLODCDK-UHFFFAOYSA-N 0 3 316.376 4.155 20 5 DIBDHN CCN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)CC(C)(C)C ZINC000463372999 339116058 /nfs/dbraw/zinc/11/60/58/339116058.db2.gz ARKCLMIDGFVNLG-UHFFFAOYSA-N 0 3 317.389 4.118 20 5 DIBDHN COc1cc(CNC(C)(C)CC(C)(C)C)c([N+](=O)[O-])cc1F ZINC000464114891 339133715 /nfs/dbraw/zinc/13/37/15/339133715.db2.gz KUXMQRQVUYKEBP-UHFFFAOYSA-N 0 3 312.385 4.047 20 5 DIBDHN C[C@@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)Sc1ccccc1 ZINC000467856865 339247757 /nfs/dbraw/zinc/24/77/57/339247757.db2.gz SHXNAMPYFTXMLC-KBPBESRZSA-N 0 3 316.426 4.426 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1cc2ccccc2o1 ZINC000467969977 339250182 /nfs/dbraw/zinc/25/01/82/339250182.db2.gz OIFRHJILQJTODE-ZDUSSCGKSA-N 0 3 310.353 4.234 20 5 DIBDHN C[C@H](CCc1ccsc1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000468041119 339252372 /nfs/dbraw/zinc/25/23/72/339252372.db2.gz SYBBXKKCNPFTRO-LLVKDONJSA-N 0 3 324.833 4.421 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNC/C=C/c1ccccc1 ZINC000468593730 339266878 /nfs/dbraw/zinc/26/68/78/339266878.db2.gz BNYKNTYAWAAETP-OUYFPJISSA-N 0 3 308.381 4.301 20 5 DIBDHN C[C@@H](CNCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000470195766 339313752 /nfs/dbraw/zinc/31/37/52/339313752.db2.gz QPORQAACCINCLB-LBPRGKRZSA-N 0 3 304.777 4.142 20 5 DIBDHN CCN(Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)c1cccc(O)c1 ZINC000471184042 339339875 /nfs/dbraw/zinc/33/98/75/339339875.db2.gz XKJKLIHKQPMBLD-AWEZNQCLSA-N 0 3 314.385 4.192 20 5 DIBDHN Cc1ccc(C)c2c1CCC[C@H]2NCc1ccccc1[N+](=O)[O-] ZINC000471598396 339348725 /nfs/dbraw/zinc/34/87/25/339348725.db2.gz WPHZCOGYFWUBAE-QGZVFWFLSA-N 0 3 310.397 4.379 20 5 DIBDHN Cc1ccc(SC[C@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000472131535 339363813 /nfs/dbraw/zinc/36/38/13/339363813.db2.gz AEEWTUXQUHFOHU-AWEZNQCLSA-N 0 3 316.426 4.174 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCCC3(CC3)C2)o1 ZINC000473059486 339380797 /nfs/dbraw/zinc/38/07/97/339380797.db2.gz QNZHYWUPIAQYHV-UHFFFAOYSA-N 0 3 312.369 4.231 20 5 DIBDHN Cc1cc2[nH]c(CNCc3cccc([N+](=O)[O-])c3C)cc2c(C)c1 ZINC000480458856 339573723 /nfs/dbraw/zinc/57/37/23/339573723.db2.gz GARIXDLYSBKPRC-UHFFFAOYSA-N 0 3 323.396 4.291 20 5 DIBDHN CC[C@H](N[C@H]1CCCO[C@@H]1CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000480753219 339586001 /nfs/dbraw/zinc/58/60/01/339586001.db2.gz AXYODICJGGXIJG-OKZBNKHCSA-N 0 3 320.433 4.229 20 5 DIBDHN CC[C@H](N[C@H]1CCCO[C@H]1CC(C)C)c1cccc([N+](=O)[O-])c1 ZINC000480753217 339586005 /nfs/dbraw/zinc/58/60/05/339586005.db2.gz AXYODICJGGXIJG-BZSNNMDCSA-N 0 3 320.433 4.229 20 5 DIBDHN CCOc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000481543123 339606135 /nfs/dbraw/zinc/60/61/35/339606135.db2.gz KEOFKYITHKSCPG-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1c([C@@H](C)NCCc2cc(F)ccc2F)cccc1[N+](=O)[O-] ZINC000484488945 339687669 /nfs/dbraw/zinc/68/76/69/339687669.db2.gz VSYIAACELXXCKD-GFCCVEGCSA-N 0 3 320.339 4.075 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CS[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000488447532 339782910 /nfs/dbraw/zinc/78/29/10/339782910.db2.gz WPRCJUTXVJDGIB-DUVNUKRYSA-N 0 3 308.447 4.084 20 5 DIBDHN CCC[C@@H](NCc1ccc([N+](=O)[O-])c(OC)c1)c1ccccc1 ZINC000493008791 339914790 /nfs/dbraw/zinc/91/47/90/339914790.db2.gz LIKYMSLFBMSMKY-MRXNPFEDSA-N 0 3 314.385 4.234 20 5 DIBDHN CC[C@@H]1C[C@]1(NCc1ccc([N+](=O)[O-])cc1)c1cccc(C)c1 ZINC000500505760 340060949 /nfs/dbraw/zinc/06/09/49/340060949.db2.gz ZHAXEAVAFCROCF-VQIMIIECSA-N 0 3 310.397 4.318 20 5 DIBDHN CC[C@H]1C[C@@]1(NCc1ccc([N+](=O)[O-])cc1)c1cccc(C)c1 ZINC000500505757 340060952 /nfs/dbraw/zinc/06/09/52/340060952.db2.gz ZHAXEAVAFCROCF-LPHOPBHVSA-N 0 3 310.397 4.318 20 5 DIBDHN C[C@@H](NCCSC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000501008838 340072203 /nfs/dbraw/zinc/07/22/03/340072203.db2.gz WMUJMMQFBZJJPI-CYBMUJFWSA-N 0 3 308.447 4.311 20 5 DIBDHN CC(C)[C@@H](C)N(C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000507225325 340214437 /nfs/dbraw/zinc/21/44/37/340214437.db2.gz CKFDOQWUSSGJCB-GFCCVEGCSA-N 0 3 319.430 4.195 20 5 DIBDHN CC(C)N(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000507997624 340236955 /nfs/dbraw/zinc/23/69/55/340236955.db2.gz IIMAGIRMGKCFKH-UHFFFAOYSA-N 0 3 300.358 4.228 20 5 DIBDHN O=[N+]([O-])c1cccc(CN(C2CC2)[C@H]2CCc3ccccc32)c1 ZINC000510663748 340305664 /nfs/dbraw/zinc/30/56/64/340305664.db2.gz OHNNWOBYTFXVIF-IBGZPJMESA-N 0 3 308.381 4.247 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCC[C@H]2c2ccccc2)c(F)c1 ZINC000513064114 340391752 /nfs/dbraw/zinc/39/17/52/340391752.db2.gz OBNIMJGPFHQIAH-FUHWJXTLSA-N 0 3 314.360 4.160 20 5 DIBDHN C[C@@H]1CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000513073586 340392103 /nfs/dbraw/zinc/39/21/03/340392103.db2.gz CRCGPPJUBMVDLD-BMIGLBTASA-N 0 3 320.776 4.396 20 5 DIBDHN CCN(CC)[C@H](CNc1ccccc1[N+](=O)[O-])c1ccsc1 ZINC000513194711 340396427 /nfs/dbraw/zinc/39/64/27/340396427.db2.gz RYMRYXXOBHRBKR-MRXNPFEDSA-N 0 3 319.430 4.151 20 5 DIBDHN CS[C@H]1CCC[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000230143289 340619126 /nfs/dbraw/zinc/61/91/26/340619126.db2.gz RXUARDRUKXHIDD-AAEUAGOBSA-N 0 3 314.838 4.012 20 5 DIBDHN CC[C@H](C)NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237001840 340667201 /nfs/dbraw/zinc/66/72/01/340667201.db2.gz CIOUHRLHGTUONQ-JTQLQIEISA-N 0 3 308.765 4.396 20 5 DIBDHN COc1cc(CN[C@@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000538703568 340838893 /nfs/dbraw/zinc/83/88/93/340838893.db2.gz QQRCEGKHRLUCBQ-GOSISDBHSA-N 0 3 314.385 4.090 20 5 DIBDHN CC[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000539092113 340872720 /nfs/dbraw/zinc/87/27/20/340872720.db2.gz XAWAUZZSONQOKY-SCLBCKFNSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@H](NCCSc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000539275591 340879070 /nfs/dbraw/zinc/87/90/70/340879070.db2.gz UZZNKJSPJIUNLZ-LBPRGKRZSA-N 0 3 320.389 4.177 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCc1cccc(F)c1F ZINC000540178415 340921017 /nfs/dbraw/zinc/92/10/17/340921017.db2.gz BSNULRAJKURNIX-GFCCVEGCSA-N 0 3 320.339 4.075 20 5 DIBDHN Cc1ccc([C@@H](NCCc2ccc([N+](=O)[O-])cc2)C2CCC2)o1 ZINC000542668624 341016346 /nfs/dbraw/zinc/01/63/46/341016346.db2.gz OPBQKIVZTDJXJG-SFHVURJKSA-N 0 3 314.385 4.170 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCCc3c(Cl)cccc32)cc1 ZINC000543598947 341050374 /nfs/dbraw/zinc/05/03/74/341050374.db2.gz JLJCUFKKMWIJQZ-KRWDZBQOSA-N 0 3 316.788 4.415 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H]1c1ccsc1 ZINC000543632171 341052210 /nfs/dbraw/zinc/05/22/10/341052210.db2.gz VYOGVEMHEPSTTE-INIZCTEOSA-N 0 3 302.399 4.302 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000544833563 341095641 /nfs/dbraw/zinc/09/56/41/341095641.db2.gz WXVDKSMQDJQXFM-YPMHNXCESA-N 0 3 304.312 4.367 20 5 DIBDHN COc1cc(CN[C@@H](C)c2c(C)cccc2C)ccc1[N+](=O)[O-] ZINC000544895388 341097810 /nfs/dbraw/zinc/09/78/10/341097810.db2.gz AWIXIWGKPUXXBP-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN C[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCCC2 ZINC000237327731 341211923 /nfs/dbraw/zinc/21/19/23/341211923.db2.gz XXUIMNVPCGJSCP-CQSZACIVSA-N 0 3 310.397 4.324 20 5 DIBDHN Cc1ccc([C@H](NCCc2ccccc2[N+](=O)[O-])C2CCC2)o1 ZINC000548710726 341270279 /nfs/dbraw/zinc/27/02/79/341270279.db2.gz SECPSUPERMKFJH-GOSISDBHSA-N 0 3 314.385 4.170 20 5 DIBDHN CSc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080347208 341272995 /nfs/dbraw/zinc/27/29/95/341272995.db2.gz WEQMXUBYPPKQCG-UHFFFAOYSA-N 0 3 316.426 4.342 20 5 DIBDHN Cc1cc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1F ZINC000080347306 341273057 /nfs/dbraw/zinc/27/30/57/341273057.db2.gz ZBRVWUJAZMSZGB-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN CC(C)(NCc1cccc2[nH]ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000080347171 341273068 /nfs/dbraw/zinc/27/30/68/341273068.db2.gz OJUHEBIVENBTDB-UHFFFAOYSA-N 0 3 309.369 4.101 20 5 DIBDHN CC(C)(NCc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000080347061 341273083 /nfs/dbraw/zinc/27/30/83/341273083.db2.gz VFYCGLKLZTVJIH-UHFFFAOYSA-N 0 3 304.777 4.273 20 5 DIBDHN CCOc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080346944 341273102 /nfs/dbraw/zinc/27/31/02/341273102.db2.gz BDGMLSNASIOHPQ-UHFFFAOYSA-N 0 3 314.385 4.018 20 5 DIBDHN O=[N+]([O-])c1ccccc1CNCCc1cc2ccccc2s1 ZINC000550266695 341313924 /nfs/dbraw/zinc/31/39/24/341313924.db2.gz ZDJCCRHUAYGONL-UHFFFAOYSA-N 0 3 312.394 4.142 20 5 DIBDHN CC(C)[C@@H]1CC[C@H]1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000552055937 341365607 /nfs/dbraw/zinc/36/56/07/341365607.db2.gz JXAQTIIMHZUCTN-UONOGXRCSA-N 0 3 316.323 4.138 20 5 DIBDHN COc1cc(C)cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000090723773 341418786 /nfs/dbraw/zinc/41/87/86/341418786.db2.gz CHGSCYRPTLYXBY-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN CC(C)c1nc(CCN[C@H](C)c2ccc([N+](=O)[O-])cc2)cs1 ZINC000157011284 519861596 /nfs/dbraw/zinc/86/15/96/519861596.db2.gz FNOFVKCDHHHGCY-GFCCVEGCSA-N 0 3 319.430 4.068 20 5 DIBDHN CC[C@H](NC[C@@H](C)c1c(C)noc1C)c1cccc([N+](=O)[O-])c1 ZINC000181630777 522610356 /nfs/dbraw/zinc/61/03/56/522610356.db2.gz MMOCDMLPHLGBGN-BZNIZROVSA-N 0 3 317.389 4.044 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000268860900 525162134 /nfs/dbraw/zinc/16/21/34/525162134.db2.gz BUZZBJDADMLQIT-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@@H](N[C@H]1CCc2c1cccc2F)c1ccc([N+](=O)[O-])cc1 ZINC000267415617 525690399 /nfs/dbraw/zinc/69/03/99/525690399.db2.gz JCLNFXWXXFQUAA-DIFFPNOSSA-N 0 3 300.333 4.072 20 5 DIBDHN C[C@@H](N[C@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000178649426 525692179 /nfs/dbraw/zinc/69/21/79/525692179.db2.gz KEIHGVVPZULQTE-DIFFPNOSSA-N 0 3 300.333 4.072 20 5 DIBDHN Cc1c([C@@H](C)N[C@@H]2CCc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000089552415 1036418138 /nfs/dbraw/zinc/41/81/38/1036418138.db2.gz YNMYTORDCVGYFW-SJKOYZFVSA-N 0 3 314.360 4.380 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]1c1cccnc1 ZINC000581396394 1037580663 /nfs/dbraw/zinc/58/06/63/1037580663.db2.gz AECGVEWHEOHYHZ-LSSBLYJVSA-N 0 3 323.396 4.230 20 5 DIBDHN CC[C@@H](NCc1ccc2cccnc2c1)c1cccc([N+](=O)[O-])c1 ZINC000610517349 1037801482 /nfs/dbraw/zinc/80/14/82/1037801482.db2.gz APCUTXJCCBRDPM-GOSISDBHSA-N 0 3 321.380 4.384 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H]2CCc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000178087904 1037814255 /nfs/dbraw/zinc/81/42/55/1037814255.db2.gz MMBOMOHKWLWYLZ-SJKOYZFVSA-N 0 3 314.360 4.380 20 5 DIBDHN CC[C@@H](N[C@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000178089123 1037814310 /nfs/dbraw/zinc/81/43/10/1037814310.db2.gz JYYDXLBHVPJOEP-MSOLQXFVSA-N 0 3 314.360 4.462 20 5 DIBDHN CCC[C@H]1[C@@H](C)CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582556 1038204395 /nfs/dbraw/zinc/20/43/95/1038204395.db2.gz XTEIMDQGGIYWLA-WFASDCNBSA-N 0 3 317.389 4.137 20 5 DIBDHN COc1ccc([C@@H](C)N(C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000603837509 1038292644 /nfs/dbraw/zinc/29/26/44/1038292644.db2.gz NZKPYRWCFHLWSV-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN O=[N+]([O-])c1cc(CNC2(c3ccccc3)CCC2)ccc1Cl ZINC000171129268 1038338533 /nfs/dbraw/zinc/33/85/33/1038338533.db2.gz RNQHHJCHCIFHAQ-UHFFFAOYSA-N 0 3 316.788 4.417 20 5 DIBDHN CCC[C@H](C)[C@@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859432 1038380618 /nfs/dbraw/zinc/38/06/18/1038380618.db2.gz RSQWFWPHHXXANI-WFASDCNBSA-N 0 3 317.389 4.137 20 5 DIBDHN CCCCC[C@@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859421 1038381289 /nfs/dbraw/zinc/38/12/89/1038381289.db2.gz BACSAKFLAAEEII-CYBMUJFWSA-N 0 3 317.389 4.281 20 5 DIBDHN CCCOc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000320329975 1038463575 /nfs/dbraw/zinc/46/35/75/1038463575.db2.gz YJJNKTNXOJURHF-AWEZNQCLSA-N 0 3 314.385 4.234 20 5 DIBDHN CSc1ccc([C@@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000075756160 1038821774 /nfs/dbraw/zinc/82/17/74/1038821774.db2.gz ROQZQDKXJUACME-CYBMUJFWSA-N 0 3 316.426 4.476 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H]2CCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000178687545 1038980233 /nfs/dbraw/zinc/98/02/33/1038980233.db2.gz AWGIHTDNNBZXFK-SJCJKPOMSA-N 0 3 314.360 4.380 20 5 DIBDHN C[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000609147439 1039817808 /nfs/dbraw/zinc/81/78/08/1039817808.db2.gz UPUZOLAPJNSTLH-IOASZLSFSA-N 0 3 306.381 4.135 20 5 DIBDHN C[C@H](N[C@H]1CCCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000092856836 1039890020 /nfs/dbraw/zinc/89/00/20/1039890020.db2.gz KCXHVUFFBZMMBM-SGTLLEGYSA-N 0 3 314.360 4.462 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCSC2(CCC2)CC1 ZINC000411871455 1040639753 /nfs/dbraw/zinc/63/97/53/1040639753.db2.gz RQQBTARKNVOLNZ-ZDUSSCGKSA-N 0 3 306.431 4.017 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCSC2(CCC2)CC1 ZINC000411869400 1040640921 /nfs/dbraw/zinc/64/09/21/1040640921.db2.gz MUTPCVWVSAUUJY-ZDUSSCGKSA-N 0 3 306.431 4.017 20 5 DIBDHN COc1cc(CN(C2CC2)C2CCCCC2)c([N+](=O)[O-])cc1F ZINC000613286012 1040860644 /nfs/dbraw/zinc/86/06/44/1040860644.db2.gz SADOMGHPSYIYMS-UHFFFAOYSA-N 0 3 322.380 4.040 20 5 DIBDHN CCN(C/C=C\c1ccccc1[N+](=O)[O-])[C@H](C)c1cccnc1 ZINC000290440272 1041506052 /nfs/dbraw/zinc/50/60/52/1041506052.db2.gz LTHVZCLPAPGBCJ-YYRKOSNBSA-N 0 3 311.385 4.086 20 5 DIBDHN CC1(C)CC[C@@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811506300 1041533069 /nfs/dbraw/zinc/53/30/69/1041533069.db2.gz PJZKQUVGVMURSD-NSHDSACASA-N 0 3 303.189 4.180 20 5 DIBDHN Cc1cc(F)ccc1[C@@H](C)NCc1cccc([N+](=O)[O-])c1C ZINC000815619034 1041974777 /nfs/dbraw/zinc/97/47/77/1041974777.db2.gz AINBLPUBDUNERK-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN CCCC(C)(C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000236768195 1042041719 /nfs/dbraw/zinc/04/17/19/1042041719.db2.gz SNKVDLIJZOXYTM-UHFFFAOYSA-N 0 3 319.430 4.387 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CNCc1ccc2sccc2c1 ZINC000569770983 1042239409 /nfs/dbraw/zinc/23/94/09/1042239409.db2.gz KCOCJDPWIIISQI-UHFFFAOYSA-N 0 3 312.394 4.408 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1 ZINC000061328344 1042308108 /nfs/dbraw/zinc/30/81/08/1042308108.db2.gz CMSRWEXAIILQJN-XHDPSFHLSA-N 0 3 302.399 4.385 20 5 DIBDHN C[C@@H](CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433239096 1042461910 /nfs/dbraw/zinc/46/19/10/1042461910.db2.gz JAFOLIIEFPWXFP-TVQRCGJNSA-N 0 3 316.323 4.105 20 5 DIBDHN C[C@H](Cc1ccsc1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000049156095 1043134758 /nfs/dbraw/zinc/13/47/58/1043134758.db2.gz PQTANQHIPUHOJQ-SNVBAGLBSA-N 0 3 310.806 4.031 20 5 DIBDHN CC(C)(CNCc1cc([N+](=O)[O-])ccc1Cl)C(C)(F)F ZINC000696586060 1043267927 /nfs/dbraw/zinc/26/79/27/1043267927.db2.gz JXCZJMVNMMDNHE-UHFFFAOYSA-N 0 3 306.740 4.019 20 5 DIBDHN CCc1ccc([C@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000268787493 1043331093 /nfs/dbraw/zinc/33/10/93/1043331093.db2.gz ARZVMQADWHUJKV-NSHDSACASA-N 0 3 320.414 4.078 20 5 DIBDHN CCc1ccc([C@@H](C)NCc2ccc(OC)c([N+](=O)[O-])c2)s1 ZINC000268787492 1043331347 /nfs/dbraw/zinc/33/13/47/1043331347.db2.gz ARZVMQADWHUJKV-LLVKDONJSA-N 0 3 320.414 4.078 20 5 DIBDHN COc1cccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000268783033 1043331432 /nfs/dbraw/zinc/33/14/32/1043331432.db2.gz JFXJOZBRTDLGJZ-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000268860899 1043338736 /nfs/dbraw/zinc/33/87/36/1043338736.db2.gz BUZZBJDADMLQIT-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCC(F)(F)C1 ZINC000872058433 1043441063 /nfs/dbraw/zinc/44/10/63/1043441063.db2.gz UNOJYXNMXUZVCW-UWVGGRQHSA-N 0 3 316.373 4.155 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)NCCC(C)(F)F ZINC000872073781 1043449778 /nfs/dbraw/zinc/44/97/78/1043449778.db2.gz RYCJWQQHCPXZQW-VIFPVBQESA-N 0 3 304.362 4.013 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCC(C)(F)F ZINC000872073780 1043450583 /nfs/dbraw/zinc/45/05/83/1043450583.db2.gz RYCJWQQHCPXZQW-SECBINFHSA-N 0 3 304.362 4.013 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](OC2CCC2)CC1 ZINC000872278760 1043487633 /nfs/dbraw/zinc/48/76/33/1043487633.db2.gz ZXVMWMRDZVAPBG-GDBMZVCRSA-N 0 3 318.417 4.079 20 5 DIBDHN CC[C@H](N[C@@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358377623 1043623504 /nfs/dbraw/zinc/62/35/04/1043623504.db2.gz JJSLTBFJZYEHQT-ZWKOTPCHSA-N 0 3 311.385 4.182 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCCc2ccc(F)cc21 ZINC000355531786 1043774544 /nfs/dbraw/zinc/77/45/44/1043774544.db2.gz KWIRTXCKWKYJJJ-GOSISDBHSA-N 0 3 314.360 4.210 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cc(C)c(O)c(C)c2)cc1[N+](=O)[O-] ZINC000290302502 1043938445 /nfs/dbraw/zinc/93/84/45/1043938445.db2.gz IAHLCSNMQZYCRR-CQSZACIVSA-N 0 3 314.385 4.076 20 5 DIBDHN CC(C)(C)OCCCCN(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000474980061 1044010543 /nfs/dbraw/zinc/01/05/43/1044010543.db2.gz YTTUCFNIEIMTSZ-UHFFFAOYSA-N 0 3 320.433 4.155 20 5 DIBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1cccc(OC)c1 ZINC000358327062 1044055062 /nfs/dbraw/zinc/05/50/62/1044055062.db2.gz SXWGSDBQDAWREW-KRWDZBQOSA-N 0 3 314.385 4.153 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC[C@@H](c2ccccc2)C(F)(F)F)cc1 ZINC000186438025 1044422209 /nfs/dbraw/zinc/42/22/09/1044422209.db2.gz VSIKPOXCGFQBRJ-HNNXBMFYSA-N 0 3 324.302 4.031 20 5 DIBDHN CC[C@@H](c1ccncc1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000565450839 1044436844 /nfs/dbraw/zinc/43/68/44/1044436844.db2.gz OVZPKGKQSCMJGH-QLBOMPFWSA-N 0 3 311.385 4.086 20 5 DIBDHN Cc1nc2c(s1)[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000361922280 1044459125 /nfs/dbraw/zinc/45/91/25/1044459125.db2.gz LKTJFFAOSPCNLZ-QMTHXVAHSA-N 0 3 317.414 4.088 20 5 DIBDHN Cc1nc2c(s1)[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000361922281 1044459140 /nfs/dbraw/zinc/45/91/40/1044459140.db2.gz LKTJFFAOSPCNLZ-YGRLFVJLSA-N 0 3 317.414 4.088 20 5 DIBDHN Cc1cc([C@@H](C)N[C@H]2CCc3c2cccc3[N+](=O)[O-])ccc1F ZINC000566476439 1044491448 /nfs/dbraw/zinc/49/14/48/1044491448.db2.gz ZFOOBFGIKHRCKW-PXAZEXFGSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1ccc2c(c1)CC[C@@H]2NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597538 1044503769 /nfs/dbraw/zinc/50/37/69/1044503769.db2.gz NLJDREUBWQVPTM-INIZCTEOSA-N 0 3 316.788 4.334 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](NCCc2ccco2)c2ccccc2)c1 ZINC000156234221 1044781630 /nfs/dbraw/zinc/78/16/30/1044781630.db2.gz WGUAYEYBDAAFBA-LJQANCHMSA-N 0 3 322.364 4.110 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN[C@H]1CCC[C@H]1c1ccccc1 ZINC000445995329 1044869401 /nfs/dbraw/zinc/86/94/01/1044869401.db2.gz SMEDOOPBFAFRGV-YOEHRIQHSA-N 0 3 314.360 4.160 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC[C@@H](F)C2)c2ccccc2)c1 ZINC000577239112 1045109612 /nfs/dbraw/zinc/10/96/12/1045109612.db2.gz LXXHDARKXRNGQC-JFIYKMOQSA-N 0 3 314.360 4.164 20 5 DIBDHN Cc1ccc(CN2CC[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000527249529 1045207671 /nfs/dbraw/zinc/20/76/71/1045207671.db2.gz CYHXGBWSDKPPIA-MRXNPFEDSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](c2ccccc2F)C1 ZINC000578120851 1045210114 /nfs/dbraw/zinc/21/01/14/1045210114.db2.gz KTMUDNLXNILFBQ-UONOGXRCSA-N 0 3 314.360 4.284 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CCCc2c(F)cccc21 ZINC000449351430 1045380025 /nfs/dbraw/zinc/38/00/25/1045380025.db2.gz PHPZUXSKFCGKLX-SFHVURJKSA-N 0 3 314.360 4.210 20 5 DIBDHN Cc1cc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000451164256 1045637344 /nfs/dbraw/zinc/63/73/44/1045637344.db2.gz SFBREESZSUGIQY-CHWSQXEVSA-N 0 3 302.349 4.454 20 5 DIBDHN CC(C)[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(F)cc1 ZINC000801521240 1045727640 /nfs/dbraw/zinc/72/76/40/1045727640.db2.gz ZFYDONDYCTWGBL-QGZVFWFLSA-N 0 3 320.339 4.360 20 5 DIBDHN Cc1c([C@H](C)N[C@@H](c2ccncc2)C2CC2)cccc1[N+](=O)[O-] ZINC000903430062 1046278863 /nfs/dbraw/zinc/27/88/63/1046278863.db2.gz XJMDVIDSIWQTRZ-SCLBCKFNSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1c([C@H](C)N[C@H]2CCc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000089552418 1046288382 /nfs/dbraw/zinc/28/83/82/1046288382.db2.gz YNMYTORDCVGYFW-SJCJKPOMSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1nc([C@H](C)NC[C@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000897466215 1046440203 /nfs/dbraw/zinc/44/02/03/1046440203.db2.gz PUFDJYAAYATYFD-QWRGUYRKSA-N 0 3 319.430 4.122 20 5 DIBDHN COc1ccc(CNCc2ccccc2C(C)C)cc1[N+](=O)[O-] ZINC000782540581 1046535871 /nfs/dbraw/zinc/53/58/71/1046535871.db2.gz WLDFBUFLLFUZDP-UHFFFAOYSA-N 0 3 314.385 4.017 20 5 DIBDHN CC(C)(CC(F)(F)F)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783718117 1046628159 /nfs/dbraw/zinc/62/81/59/1046628159.db2.gz NZCCMYHFCBNJTD-UHFFFAOYSA-N 0 3 310.703 4.069 20 5 DIBDHN C[C@H](Cc1cccs1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000071269826 1047436279 /nfs/dbraw/zinc/43/62/79/1047436279.db2.gz NKNODXFLMOGCKZ-SNVBAGLBSA-N 0 3 310.806 4.031 20 5 DIBDHN CCOc1ccc([C@H](C)NCc2ccccc2C)cc1[N+](=O)[O-] ZINC000152606144 1047450109 /nfs/dbraw/zinc/45/01/09/1047450109.db2.gz ZBAYUWJCJWLSSS-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN CSC[C@@H]1CCCN1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000538751980 1047708647 /nfs/dbraw/zinc/70/86/47/1047708647.db2.gz AAYOEPVUFIWBBE-AWEZNQCLSA-N 0 3 308.447 4.046 20 5 DIBDHN C[C@@H](N[C@@H](C)COCC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC001198000665 1047912295 /nfs/dbraw/zinc/91/22/95/1047912295.db2.gz IQYOZCKCQXWWPD-LSDHHAIUSA-N 0 3 320.433 4.231 20 5 DIBDHN C/C=C/C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC001175052529 1048112621 /nfs/dbraw/zinc/11/26/21/1048112621.db2.gz GXNFIRMPJFWMIV-UJAVWCLSSA-N 0 3 318.417 4.172 20 5 DIBDHN Cc1cc([C@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)ccc1F ZINC000776232889 1048431398 /nfs/dbraw/zinc/43/13/98/1048431398.db2.gz TXZIGHKMZJKBER-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(CC2CCCCC2)C2CC2)c(F)c1 ZINC001190426139 1048736866 /nfs/dbraw/zinc/73/68/66/1048736866.db2.gz ACIFWAJXNULJDD-UHFFFAOYSA-N 0 3 306.381 4.279 20 5 DIBDHN CCOc1cc(CN2CCC(CC)(CC)C2)ccc1[N+](=O)[O-] ZINC001191541242 1048961719 /nfs/dbraw/zinc/96/17/19/1048961719.db2.gz PXGOTVZBYLYDHB-UHFFFAOYSA-N 0 3 306.406 4.006 20 5 DIBDHN CCC[C@H](C)[C@@H]1CCCN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001192173989 1049053950 /nfs/dbraw/zinc/05/39/50/1049053950.db2.gz NPNBACQFZOTYFL-WFASDCNBSA-N 0 3 324.396 4.143 20 5 DIBDHN Cc1ccc(CNCc2ccc(F)c3ccccc23)cc1[N+](=O)[O-] ZINC001179390057 1049162275 /nfs/dbraw/zinc/16/22/75/1049162275.db2.gz APJGHCGSOQCSPU-UHFFFAOYSA-N 0 3 324.355 4.485 20 5 DIBDHN C[C@@H](NC/C=C\c1ccc(F)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001179575888 1049179895 /nfs/dbraw/zinc/17/98/95/1049179895.db2.gz YJTIKGZNDIFKNP-ZZKXABKFSA-N 0 3 318.323 4.237 20 5 DIBDHN C[C@H](NC/C=C/c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001179580003 1049185990 /nfs/dbraw/zinc/18/59/90/1049185990.db2.gz ZIRDKQZJYSZJRR-LQPUYASZSA-N 0 3 300.333 4.098 20 5 DIBDHN CC[C@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001180198865 1049317206 /nfs/dbraw/zinc/31/72/06/1049317206.db2.gz KNSSROFWCVXBTF-NSHDSACASA-N 0 3 316.323 4.236 20 5 DIBDHN CCC1(c2ccccc2)CN(Cc2c(C)ccc([N+](=O)[O-])c2C)C1 ZINC001182261974 1049601277 /nfs/dbraw/zinc/60/12/77/1049601277.db2.gz PNHXZEIOHRVQJU-UHFFFAOYSA-N 0 3 324.424 4.375 20 5 DIBDHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000734488141 1050276358 /nfs/dbraw/zinc/27/63/58/1050276358.db2.gz ZLMOEVGNEKBXGO-HIFRSBDPSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000734488143 1050277457 /nfs/dbraw/zinc/27/74/57/1050277457.db2.gz ZLMOEVGNEKBXGO-ZFWWWQNUSA-N 0 3 314.360 4.112 20 5 DIBDHN Cc1c(CN[C@@H](CC(C)C)c2ccncc2)cccc1[N+](=O)[O-] ZINC000592389648 1050296757 /nfs/dbraw/zinc/29/67/57/1050296757.db2.gz ABCHSEHQZHKHAI-KRWDZBQOSA-N 0 3 313.401 4.175 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H]1CCCc2sccc21 ZINC000574414465 1050455066 /nfs/dbraw/zinc/45/50/66/1050455066.db2.gz NHGUQBWDKYXEIR-CABCVRRESA-N 0 3 314.410 4.311 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H]1CCCc2ccccc21 ZINC000594492321 1050517535 /nfs/dbraw/zinc/51/75/35/1050517535.db2.gz NLPKPHKXGJESLJ-ROUUACIJSA-N 0 3 308.381 4.249 20 5 DIBDHN Cc1ccc2c(c1)[C@H](N[C@@H]1CCc3c1cccc3[N+](=O)[O-])CC2 ZINC000594500999 1050522102 /nfs/dbraw/zinc/52/21/02/1050522102.db2.gz CLZVDLJGAAOZFK-QZTJIDSGSA-N 0 3 308.381 4.168 20 5 DIBDHN CC[C@@H](Nc1cc2c(cc1[N+](=O)[O-])CNC2)c1ccccc1C ZINC001171199495 1050619108 /nfs/dbraw/zinc/61/91/08/1050619108.db2.gz DNAIDHZVUMFICJ-MRXNPFEDSA-N 0 3 311.385 4.070 20 5 DIBDHN CCC(C)(C)[C@H](C)NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000595642699 1050657635 /nfs/dbraw/zinc/65/76/35/1050657635.db2.gz QULNVSALLIYFML-LBPRGKRZSA-N 0 3 317.389 4.164 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)cc1CN1CC[C@@H](C2CCCC2)C1 ZINC001171332365 1050943850 /nfs/dbraw/zinc/94/38/50/1050943850.db2.gz OTFYCMMASWBCRN-CYBMUJFWSA-N 0 3 308.809 4.260 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc([N+](=O)[O-])c(Cl)c2)s1 ZINC000761524114 1051584322 /nfs/dbraw/zinc/58/43/22/1051584322.db2.gz VEIAGZUJGSSLHH-SNVBAGLBSA-N 0 3 310.806 4.469 20 5 DIBDHN C[C@@H]1Cc2ccccc2[C@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522473 1051585778 /nfs/dbraw/zinc/58/57/78/1051585778.db2.gz ZCUODFGLUNDYPH-DIFFPNOSSA-N 0 3 316.788 4.271 20 5 DIBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)N[C@@H](C)c1c(F)cccc1F ZINC001173220349 1051636528 /nfs/dbraw/zinc/63/65/28/1051636528.db2.gz YRTFTMSXYJIGGE-NEPJUHHUSA-N 0 3 320.339 4.155 20 5 DIBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(C)Cc1ccccc1Cl ZINC001173225041 1051639226 /nfs/dbraw/zinc/63/92/26/1051639226.db2.gz BAXLBOJTNKZGNL-ZDUSSCGKSA-N 0 3 318.804 4.311 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc(Cl)cc1 ZINC000152918956 1051690224 /nfs/dbraw/zinc/69/02/24/1051690224.db2.gz LKSHDTQFKYDKDT-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN Cc1cc(C)c2ccc3cccc(O[C@@H]4CCNC[C@@H]4F)c3c2n1 ZINC001218073103 1052192640 /nfs/dbraw/zinc/19/26/40/1052192640.db2.gz YWURGIATTRTVRR-DLBZAZTESA-N 0 3 324.399 4.084 20 5 DIBDHN CC(C)c1ccc2c(c1)[C@H](NCc1cccc([N+](=O)[O-])c1)CC2 ZINC000495154475 1052238340 /nfs/dbraw/zinc/23/83/40/1052238340.db2.gz CKDLUYVYPKUCBW-LJQANCHMSA-N 0 3 310.397 4.495 20 5 DIBDHN COc1cccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193899987 1052511074 /nfs/dbraw/zinc/51/10/74/1052511074.db2.gz NPMPSEOWKVJQRW-QWHCGFSZSA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000609672587 1052986279 /nfs/dbraw/zinc/98/62/79/1052986279.db2.gz QQCHMEVSFCTPRU-ZFWWWQNUSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1csc([N+](=O)[O-])c1 ZINC000609672649 1052986306 /nfs/dbraw/zinc/98/63/06/1052986306.db2.gz NUUWLGIDODNSLW-IUODEOHRSA-N 0 3 302.399 4.034 20 5 DIBDHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1csc([N+](=O)[O-])c1 ZINC000609672650 1052986535 /nfs/dbraw/zinc/98/65/35/1052986535.db2.gz NUUWLGIDODNSLW-SWLSCSKDSA-N 0 3 302.399 4.034 20 5 DIBDHN CCN(C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccoc1 ZINC000615834436 1053032989 /nfs/dbraw/zinc/03/29/89/1053032989.db2.gz SMIHGPGYUSXXRH-NTEUORMPSA-N 0 3 300.358 4.113 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc2c(c1)CCC2 ZINC001319783594 1053274407 /nfs/dbraw/zinc/27/44/07/1053274407.db2.gz HEHXTUSOWJILJC-AWEZNQCLSA-N 0 3 310.397 4.243 20 5 DIBDHN CN(Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC001323285780 1053573451 /nfs/dbraw/zinc/57/34/51/1053573451.db2.gz KQRLORLSKXEUMB-UHFFFAOYSA-N 0 3 306.749 4.102 20 5 DIBDHN CC[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC001329112516 1053968133 /nfs/dbraw/zinc/96/81/33/1053968133.db2.gz FVQFPCKQQYOJDQ-DLBZAZTESA-N 0 3 314.360 4.462 20 5 DIBDHN C[C@H](N[C@@H]1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC000081181374 1053991692 /nfs/dbraw/zinc/99/16/92/1053991692.db2.gz DLRNCIRPOHFQBB-APPDUMDISA-N 0 3 300.333 4.072 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000848526945 1054127263 /nfs/dbraw/zinc/12/72/63/1054127263.db2.gz MNWJLWLKAKDJPH-FZMZJTMJSA-N 0 3 302.399 4.303 20 5 DIBDHN CC(C)(C)CC(C)(C)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083168793 1054840136 /nfs/dbraw/zinc/84/01/36/1054840136.db2.gz HKZUTVDQONARHP-UHFFFAOYSA-N 0 3 305.378 4.040 20 5 DIBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1 ZINC000075675586 1055443057 /nfs/dbraw/zinc/44/30/57/1055443057.db2.gz XZUFCEBTEPBBDH-NSHDSACASA-N 0 3 324.302 4.464 20 5 DIBDHN CCOc1ccc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC001620818406 1056090056 /nfs/dbraw/zinc/09/00/56/1056090056.db2.gz VCOFVHKIHVWJSH-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN c1ccc2cc3cc(-c4ncc5c(n4)CNCC5)ccc3cc2c1 ZINC001240680345 1056636481 /nfs/dbraw/zinc/63/64/81/1056636481.db2.gz ULNVUKVYDVKMTM-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN CC(C)CN(Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])CC(C)(C)C ZINC001616339171 1056637692 /nfs/dbraw/zinc/63/76/92/1056637692.db2.gz VZZBFQVIWZHZAG-UHFFFAOYSA-N 0 3 323.393 4.007 20 5 DIBDHN Cc1ccc(CCN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC001616474905 1056663632 /nfs/dbraw/zinc/66/36/32/1056663632.db2.gz DTOFDRMJZWFLKK-UHFFFAOYSA-N 0 3 310.397 4.110 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC=C(c2cccnc2)C1 ZINC000347715157 1057013940 /nfs/dbraw/zinc/01/39/40/1057013940.db2.gz GACHEKSSLCVMDQ-HNNXBMFYSA-N 0 3 323.396 4.149 20 5 DIBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCC2 ZINC000390856937 1057051103 /nfs/dbraw/zinc/05/11/03/1057051103.db2.gz ADDPHCGHHQDQNK-UONOGXRCSA-N 0 3 310.397 4.495 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000172831456 1057269540 /nfs/dbraw/zinc/26/95/40/1057269540.db2.gz OVYWJCCNEVHARN-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@H](NC1(c2ccc(F)cc2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000611470546 1057602445 /nfs/dbraw/zinc/60/24/45/1057602445.db2.gz RBNZPMSXWHDYCB-ZDUSSCGKSA-N 0 3 314.360 4.464 20 5 DIBDHN C[C@@H](CN(C)Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 ZINC001559522943 1059320212 /nfs/dbraw/zinc/32/02/12/1059320212.db2.gz BQOAIHNFHNQODC-ZDUSSCGKSA-N 0 3 318.804 4.484 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCCC[C@H]1C(C)C ZINC001559540994 1059343790 /nfs/dbraw/zinc/34/37/90/1059343790.db2.gz FURMILPNHPUHJH-KRWDZBQOSA-N 0 3 320.433 4.393 20 5 DIBDHN C[C@@H]1CCC[C@@H](CCN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001559595109 1059428062 /nfs/dbraw/zinc/42/80/62/1059428062.db2.gz YSZIULCOKWAMOO-CABCVRRESA-N 0 3 302.418 4.169 20 5 DIBDHN CCN(Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC(C)(C)C1 ZINC001559904839 1059721138 /nfs/dbraw/zinc/72/11/38/1059721138.db2.gz KVULJUCONUNPFP-UHFFFAOYSA-N 0 3 320.433 4.393 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CC[C@H](C2CCCCC2)C1 ZINC001559977467 1059785961 /nfs/dbraw/zinc/78/59/61/1059785961.db2.gz WDVFVCPSNNFMEJ-AWEZNQCLSA-N 0 3 306.381 4.136 20 5 DIBDHN Cc1ccc(CN2CCC3(CCCCC3)CC2)cc1[N+](=O)[O-] ZINC001559981232 1059787838 /nfs/dbraw/zinc/78/78/38/1059787838.db2.gz JEIFETPZTFLPIH-UHFFFAOYSA-N 0 3 302.418 4.450 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@@]1(C)C1CCCCC1 ZINC001560095439 1059901873 /nfs/dbraw/zinc/90/18/73/1059901873.db2.gz ABYLIMNVNSGCMT-SFHVURJKSA-N 0 3 318.417 4.148 20 5 DIBDHN Cc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC001560587367 1060400714 /nfs/dbraw/zinc/40/07/14/1060400714.db2.gz JQISUJCQOJJUID-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN C[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)C1CCCCCC1 ZINC001473369445 1061116219 /nfs/dbraw/zinc/11/62/19/1061116219.db2.gz QYSQDVFXNBSHAW-LLVKDONJSA-N 0 3 312.360 4.322 20 5 DIBDHN CC1(C)CCC[C@H]1CCNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001462454541 1061183936 /nfs/dbraw/zinc/18/39/36/1061183936.db2.gz GXDJOJKIMPZTON-LBPRGKRZSA-N 0 3 317.389 4.042 20 5 DIBDHN C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1csc([N+](=O)[O-])c1 ZINC001473818835 1061421893 /nfs/dbraw/zinc/42/18/93/1061421893.db2.gz XGDJNHHLSQXEES-XJKSGUPXSA-N 0 3 316.426 4.424 20 5 DIBDHN Cc1ccc(CNCc2ccc(CC(C)C)cc2)cc1[N+](=O)[O-] ZINC001474240260 1061801343 /nfs/dbraw/zinc/80/13/43/1061801343.db2.gz YDSRQFSOYSFSAC-UHFFFAOYSA-N 0 3 312.413 4.392 20 5 DIBDHN CCOc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC001474265592 1061832274 /nfs/dbraw/zinc/83/22/74/1061832274.db2.gz BSBXBAYVOHGNIM-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCS[C@@H]2CCCC[C@@H]21 ZINC001474343611 1061946464 /nfs/dbraw/zinc/94/64/64/1061946464.db2.gz SEKGWCBKKKPHMA-DLBZAZTESA-N 0 3 320.458 4.072 20 5 DIBDHN CN(CCc1ccccc1F)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001474366636 1061998133 /nfs/dbraw/zinc/99/81/33/1061998133.db2.gz WLCRSTQAMSNKSJ-UHFFFAOYSA-N 0 3 322.767 4.062 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(F)cc1Cl ZINC001254534724 1062164478 /nfs/dbraw/zinc/16/44/78/1062164478.db2.gz BZUPOBISLKLGNG-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(F)cc1Cl ZINC001254534723 1062164582 /nfs/dbraw/zinc/16/45/82/1062164582.db2.gz BZUPOBISLKLGNG-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1cccc(F)c1Cl ZINC001254539323 1062166927 /nfs/dbraw/zinc/16/69/27/1062166927.db2.gz HDCNNDKCYRNDPA-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@@H](N[C@@H](C)Cc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC001254545857 1062170071 /nfs/dbraw/zinc/17/00/71/1062170071.db2.gz QAYSWJNUPWJANP-NWDGAFQWSA-N 0 3 320.339 4.155 20 5 DIBDHN CC(C)(C)SCCCN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001459686313 1062306637 /nfs/dbraw/zinc/30/66/37/1062306637.db2.gz KSTOGVDGXASQLV-UHFFFAOYSA-N 0 3 322.474 4.481 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCCC3(CCCCC3)C2)cc1F ZINC001473153242 1063456954 /nfs/dbraw/zinc/45/69/54/1063456954.db2.gz ZETRGJWHYYAZNL-UHFFFAOYSA-N 0 3 306.381 4.280 20 5 DIBDHN CCn1nccc1CNCc1c2ccccc2cc2ccccc21 ZINC001461643731 1063630020 /nfs/dbraw/zinc/63/00/20/1063630020.db2.gz NHKZQTXZJHORBE-UHFFFAOYSA-N 0 3 315.420 4.499 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)CCC[C@@H]1C ZINC001307478087 1065425222 /nfs/dbraw/zinc/42/52/22/1065425222.db2.gz ISEUSHLTDYFNAB-GJZGRUSLSA-N 0 3 320.433 4.393 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN(CCC1=CCCCC1)C1CC1 ZINC001307596923 1065506847 /nfs/dbraw/zinc/50/68/47/1065506847.db2.gz DOKAHYTZEPPZOB-UHFFFAOYSA-N 0 3 300.402 4.450 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@@H]1CCC(C)(C)C1 ZINC001307738529 1065595347 /nfs/dbraw/zinc/59/53/47/1065595347.db2.gz JIDLQCSAHDXOHY-MRXNPFEDSA-N 0 3 320.433 4.393 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@H]1CCC(C)(C)C1 ZINC001307738527 1065597055 /nfs/dbraw/zinc/59/70/55/1065597055.db2.gz JIDLQCSAHDXOHY-INIZCTEOSA-N 0 3 320.433 4.393 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc2cccnc12 ZINC001308207491 1065815479 /nfs/dbraw/zinc/81/54/79/1065815479.db2.gz ADROFVUAOWSRIX-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN Cc1ccc2c(c1)[C@@H](NCc1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000570703360 332803855 /nfs/dbraw/zinc/80/38/55/332803855.db2.gz UQPSYRSDFCOOPR-IBGZPJMESA-N 0 3 310.397 4.379 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H](c2cccnc2)C2CC2)cc1[N+](=O)[O-] ZINC000537948159 331535540 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C[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCC2 ZINC000390856941 333400116 /nfs/dbraw/zinc/40/01/16/333400116.db2.gz ADDPHCGHHQDQNK-ZIAGYGMSSA-N 0 3 310.397 4.495 20 5 DIBDHN C[C@@H](N[C@@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1 ZINC000061328347 333427609 /nfs/dbraw/zinc/42/76/09/333427609.db2.gz CMSRWEXAIILQJN-IAQYHMDHSA-N 0 3 302.399 4.385 20 5 DIBDHN Cc1ccc([C@H](C)NCCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000320292374 333499092 /nfs/dbraw/zinc/49/90/92/333499092.db2.gz QJHNKXAEYMSGFF-HNNXBMFYSA-N 0 3 314.385 4.023 20 5 DIBDHN COc1cccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000268783043 333994250 /nfs/dbraw/zinc/99/42/50/333994250.db2.gz JFXJOZBRTDLGJZ-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1ccc2cc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2n1 ZINC000187640853 334266354 /nfs/dbraw/zinc/26/63/54/334266354.db2.gz UYTHOQHGIHJKLJ-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CCOc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000192543773 336073534 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O=[N+]([O-])c1ccc(CN[C@H]2CCCc3c4ccccc4[nH]c32)cc1 ZINC000289281164 337602642 /nfs/dbraw/zinc/60/26/42/337602642.db2.gz QDWWDBAIKRXRPS-SFHVURJKSA-N 0 3 321.380 4.243 20 5 DIBDHN CCNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000061003245 337924200 /nfs/dbraw/zinc/92/42/00/337924200.db2.gz AVCJLGULAVYBRJ-UHFFFAOYSA-N 0 3 306.749 4.150 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)N[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000437099226 338300755 /nfs/dbraw/zinc/30/07/55/338300755.db2.gz QKNLIOHXRGUWAK-MFKMUULPSA-N 0 3 304.312 4.222 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000437113340 338301649 /nfs/dbraw/zinc/30/16/49/338301649.db2.gz WRGKMDXPGFNTFQ-GXFFZTMASA-N 0 3 304.312 4.222 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@H]2CC[C@H](Cc3ccccc3)C2)cs1 ZINC000438355210 338341056 /nfs/dbraw/zinc/34/10/56/338341056.db2.gz RSGIHGFDIMIMFG-ZBFHGGJFSA-N 0 3 316.426 4.157 20 5 DIBDHN COCC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000451101020 338721117 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Cc1cccc(O[C@H](C)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000467851216 339247693 /nfs/dbraw/zinc/24/76/93/339247693.db2.gz BLEKMGDQAVXKHV-CABCVRRESA-N 0 3 314.385 4.021 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc2ccccc2n1 ZINC000468010416 339251144 /nfs/dbraw/zinc/25/11/44/339251144.db2.gz XZQZEGPMFZZULP-AWEZNQCLSA-N 0 3 321.380 4.036 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1cc2ccccc2[nH]1 ZINC000468644625 339267878 /nfs/dbraw/zinc/26/78/78/339267878.db2.gz DMHUGVFOQGZBKQ-NTEUORMPSA-N 0 3 321.380 4.269 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNCc1ccc(C)s1 ZINC000468645312 339267936 /nfs/dbraw/zinc/26/79/36/339267936.db2.gz MMTHELXRCQLEGA-XYOKQWHBSA-N 0 3 302.399 4.158 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H]1c1ccccc1 ZINC000470172983 339312766 /nfs/dbraw/zinc/31/27/66/339312766.db2.gz GKTJZNGCBASIOQ-RYBIEJRYSA-N 0 3 308.381 4.445 20 5 DIBDHN Cc1ccc(SC[C@@H](C)NCc2csc([N+](=O)[O-])c2)cc1 ZINC000472151744 339364577 /nfs/dbraw/zinc/36/45/77/339364577.db2.gz GHPDCGGWICSPOV-GFCCVEGCSA-N 0 3 322.455 4.235 20 5 DIBDHN C[C@H](NC[C@@H]1CCC2(CCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000477863555 339503265 /nfs/dbraw/zinc/50/32/65/339503265.db2.gz OYDNTGWSOIFVEY-YOEHRIQHSA-N 0 3 318.417 4.127 20 5 DIBDHN Cc1cscc1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000494464842 339950206 /nfs/dbraw/zinc/95/02/06/339950206.db2.gz LXAXTSKCNSVTDG-INIZCTEOSA-N 0 3 302.399 4.132 20 5 DIBDHN C[C@]1(c2ccccc2)CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000500233853 340053707 /nfs/dbraw/zinc/05/37/07/340053707.db2.gz UXSKTULMTPZFAA-IBGZPJMESA-N 0 3 310.397 4.149 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC[C@@H]2CCCC(F)(F)C2)c(Cl)c1 ZINC000500357520 340055679 /nfs/dbraw/zinc/05/56/79/340055679.db2.gz KGYXFOFESGECLJ-SNVBAGLBSA-N 0 3 318.751 4.163 20 5 DIBDHN O=[N+]([O-])c1ccc(CNCC2CCC(F)(F)CC2)c(Cl)c1 ZINC000500440923 340058838 /nfs/dbraw/zinc/05/88/38/340058838.db2.gz NVCZOPSVWZBMIX-UHFFFAOYSA-N 0 3 318.751 4.163 20 5 DIBDHN C[C@H](NCCSC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000501016269 340072433 /nfs/dbraw/zinc/07/24/33/340072433.db2.gz UEKOVKKJAHBUBR-ZDUSSCGKSA-N 0 3 308.447 4.311 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@H](c2ccccc2)C1 ZINC000507079431 340206661 /nfs/dbraw/zinc/20/66/61/340206661.db2.gz XCJOAYPAKGRYTN-TWVNLXSWSA-N 0 3 308.381 4.098 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@H](c2ccccc2)C1 ZINC000507079430 340206670 /nfs/dbraw/zinc/20/66/70/340206670.db2.gz XCJOAYPAKGRYTN-OPUMOTSWSA-N 0 3 308.381 4.098 20 5 DIBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2cc[nH]c21 ZINC000507151701 340209661 /nfs/dbraw/zinc/20/96/61/340209661.db2.gz JOKYEYAPMARPIO-UHFFFAOYSA-N 0 3 323.396 4.487 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC=C(c2ccco2)C1 ZINC000511060358 340319728 /nfs/dbraw/zinc/31/97/28/340319728.db2.gz RHFDAOFNTOLDBK-AWEZNQCLSA-N 0 3 312.369 4.347 20 5 DIBDHN C[C@@H](c1ccc(F)c(F)c1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511083444 340320176 /nfs/dbraw/zinc/32/01/76/340320176.db2.gz ZXBDYWBSWRPSDI-LBPRGKRZSA-N 0 3 320.339 4.109 20 5 DIBDHN C[C@H](c1ccc(F)c(F)c1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511083443 340320200 /nfs/dbraw/zinc/32/02/00/340320200.db2.gz ZXBDYWBSWRPSDI-GFCCVEGCSA-N 0 3 320.339 4.109 20 5 DIBDHN C[C@H]1CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000513073587 340392188 /nfs/dbraw/zinc/39/21/88/340392188.db2.gz CRCGPPJUBMVDLD-BONVTDFDSA-N 0 3 320.776 4.396 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)c1ccc2n[nH]cc2c1 ZINC000513189419 340396292 /nfs/dbraw/zinc/39/62/92/340396292.db2.gz YAMLBKKOAOGHRR-STQMWFEESA-N 0 3 324.384 4.191 20 5 DIBDHN C[C@H](N[C@H]1CCCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000089214369 340466586 /nfs/dbraw/zinc/46/65/86/340466586.db2.gz DZNUZUHZUOTFQP-SGTLLEGYSA-N 0 3 314.360 4.462 20 5 DIBDHN C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1csc(Cl)c1 ZINC000230409300 340620159 /nfs/dbraw/zinc/62/01/59/340620159.db2.gz JMVZCPBRUWIUDW-SNVBAGLBSA-N 0 3 310.806 4.203 20 5 DIBDHN CCC[C@@H](N[C@H](C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000231791861 340626140 /nfs/dbraw/zinc/62/61/40/340626140.db2.gz SIQFOPBHUVMPJN-ZWNOBZJWSA-N 0 3 304.312 4.367 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000537990687 340806046 /nfs/dbraw/zinc/80/60/46/340806046.db2.gz JYDPGIZEDQEZSE-MRXNPFEDSA-N 0 3 302.761 4.025 20 5 DIBDHN Cc1cc([C@H](C)NCCOc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000539365504 340882638 /nfs/dbraw/zinc/88/26/38/340882638.db2.gz XOHZBISNYJXPDU-LBPRGKRZSA-N 0 3 320.414 4.003 20 5 DIBDHN C[C@H](NCCc1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000540150326 340917434 /nfs/dbraw/zinc/91/74/34/340917434.db2.gz INNOKMQUCLUNLF-LBPRGKRZSA-N 0 3 304.777 4.142 20 5 DIBDHN CC[C@@H](NCc1ccc(OC)cc1C)c1cccc([N+](=O)[O-])c1 ZINC000540160281 340918883 /nfs/dbraw/zinc/91/88/83/340918883.db2.gz BSGSEODOLALJPA-GOSISDBHSA-N 0 3 314.385 4.153 20 5 DIBDHN C[C@@H](N[C@@H]1CCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000540167743 340919930 /nfs/dbraw/zinc/91/99/30/340919930.db2.gz SENDKZZSYFVSPE-PIGZYNQJSA-N 0 3 300.333 4.072 20 5 DIBDHN C[C@H](NCCc1ccccc1Cl)c1ccccc1[N+](=O)[O-] ZINC000540425343 340930901 /nfs/dbraw/zinc/93/09/01/340930901.db2.gz WMNHTUIEPNQJQE-LBPRGKRZSA-N 0 3 304.777 4.142 20 5 DIBDHN Cc1ccc(CN[C@@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000543748298 341056636 /nfs/dbraw/zinc/05/66/36/341056636.db2.gz RJOVHMOULHZQOU-IBGZPJMESA-N 0 3 310.397 4.245 20 5 DIBDHN C[C@@H](Cc1ccsc1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000543986283 341065097 /nfs/dbraw/zinc/06/50/97/341065097.db2.gz OZRZLAYOXUCXAZ-ZDUSSCGKSA-N 0 3 316.426 4.252 20 5 DIBDHN CC(C)c1ccc(CNC[C@@H]2CCCCS2)cc1[N+](=O)[O-] ZINC000544179148 341073106 /nfs/dbraw/zinc/07/31/06/341073106.db2.gz ZBLKOXVZHDHJPH-AWEZNQCLSA-N 0 3 308.447 4.094 20 5 DIBDHN COc1ccc([C@@H](C)N(C)Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000544611590 341089038 /nfs/dbraw/zinc/08/90/38/341089038.db2.gz HELDGWGNPWYYPK-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1ccc([C@@H](NCCc2cccc([N+](=O)[O-])c2)C2CCC2)o1 ZINC000544614956 341089202 /nfs/dbraw/zinc/08/92/02/341089202.db2.gz VEJFNHVCINEWEA-SFHVURJKSA-N 0 3 314.385 4.170 20 5 DIBDHN COC[C@@H](C)N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000131849132 341112759 /nfs/dbraw/zinc/11/27/59/341112759.db2.gz KWFZLGUWYQCJDB-VXGBXAGGSA-N 0 3 320.414 4.009 20 5 DIBDHN Cc1c([C@@H](C)NCCCNc2ccccc2)cccc1[N+](=O)[O-] ZINC000132065244 341115811 /nfs/dbraw/zinc/11/58/11/341115811.db2.gz GRKMNNUOFDUYOD-OAHLLOKOSA-N 0 3 313.401 4.056 20 5 DIBDHN Cc1ccc2nccc(N3CCc4c(cccc4[N+](=O)[O-])C3)c2c1 ZINC000545469268 341126549 /nfs/dbraw/zinc/12/65/49/341126549.db2.gz MQTJMTZHNRXLOX-UHFFFAOYSA-N 0 3 319.364 4.014 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC2(c3ccc(F)cc3)CCCC2)cc1 ZINC000237744314 341219391 /nfs/dbraw/zinc/21/93/91/341219391.db2.gz RSFVVNXFLFNHOX-UHFFFAOYSA-N 0 3 314.360 4.293 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCO[C@H]1CC(C)C ZINC000547831496 341236081 /nfs/dbraw/zinc/23/60/81/341236081.db2.gz LEAAJBLJHPYPLP-QGTPRVQTSA-N 0 3 320.433 4.148 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000079121493 341253946 /nfs/dbraw/zinc/25/39/46/341253946.db2.gz QHSFMCYWTYXQPC-STQMWFEESA-N 0 3 302.349 4.454 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H](C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000079121495 341253973 /nfs/dbraw/zinc/25/39/73/341253973.db2.gz QHSFMCYWTYXQPC-CHWSQXEVSA-N 0 3 302.349 4.454 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCC[C@@H]3F)s2)cc1 ZINC000550319779 341315035 /nfs/dbraw/zinc/31/50/35/341315035.db2.gz HDNZQWZUXYYJMC-LSDHHAIUSA-N 0 3 320.389 4.304 20 5 DIBDHN C[C@@H](CN[C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000552557520 341398700 /nfs/dbraw/zinc/39/87/00/341398700.db2.gz VBYOABMKWAYFQN-QWHCGFSZSA-N 0 3 302.349 4.188 20 5 DIBDHN Cc1c([C@H](C)N[C@@H](c2cccnc2)C2CC2)cccc1[N+](=O)[O-] ZINC000552580313 341399643 /nfs/dbraw/zinc/39/96/43/341399643.db2.gz ZOULSIOWPZOKSD-SCLBCKFNSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1c([C@H](C)N[C@H](c2cccnc2)C2CC2)cccc1[N+](=O)[O-] ZINC000552580314 341399667 /nfs/dbraw/zinc/39/96/67/341399667.db2.gz ZOULSIOWPZOKSD-UGSOOPFHSA-N 0 3 311.385 4.100 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCC2(F)CCC2)o1 ZINC000554727266 341462492 /nfs/dbraw/zinc/46/24/92/341462492.db2.gz ZXHMEVCEAPBHCR-UHFFFAOYSA-N 0 3 318.348 4.227 20 5 DIBDHN CCC1(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1 ZINC000177712814 341924799 /nfs/dbraw/zinc/92/47/99/341924799.db2.gz BJWJAJGGKUHCMM-UHFFFAOYSA-N 0 3 317.414 4.141 20 5 DIBDHN CC[C@@H](NC[C@H](C)c1c(C)noc1C)c1cccc([N+](=O)[O-])c1 ZINC000181630835 522859253 /nfs/dbraw/zinc/85/92/53/522859253.db2.gz MMOCDMLPHLGBGN-MEDUHNTESA-N 0 3 317.389 4.044 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1cccc2cccnc21 ZINC000120516247 1035865359 /nfs/dbraw/zinc/86/53/59/1035865359.db2.gz YNLAMLONJOWDAR-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CC[C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC001167377992 1037042622 /nfs/dbraw/zinc/04/26/22/1037042622.db2.gz XTXZEFMSDFRJLN-OAHLLOKOSA-N 0 3 320.433 4.394 20 5 DIBDHN Cc1c(CN[C@]2(C)CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000537596168 1037268267 /nfs/dbraw/zinc/26/82/67/1037268267.db2.gz XENQDHOUAVOSJT-LJQANCHMSA-N 0 3 310.397 4.245 20 5 DIBDHN CC[C@H](NCc1ccc2cccnc2c1)c1cccc([N+](=O)[O-])c1 ZINC000610517350 1037801837 /nfs/dbraw/zinc/80/18/37/1037801837.db2.gz APCUTXJCCBRDPM-SFHVURJKSA-N 0 3 321.380 4.384 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H]2CCc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000178087928 1037813598 /nfs/dbraw/zinc/81/35/98/1037813598.db2.gz MMBOMOHKWLWYLZ-PXAZEXFGSA-N 0 3 314.360 4.380 20 5 DIBDHN CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 ZINC000761250765 1037998211 /nfs/dbraw/zinc/99/82/11/1037998211.db2.gz NAJSIQJJCXUNSR-INIZCTEOSA-N 0 3 316.788 4.368 20 5 DIBDHN CCCc1ccc(CNCc2cccc([N+](=O)[O-])c2C)s1 ZINC000598634450 1038141760 /nfs/dbraw/zinc/14/17/60/1038141760.db2.gz FWFNYYHPDYJBRO-UHFFFAOYSA-N 0 3 304.415 4.207 20 5 DIBDHN C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCCC2 ZINC000061028316 1038171282 /nfs/dbraw/zinc/17/12/82/1038171282.db2.gz JNTDFXBQUCJKEF-CQSZACIVSA-N 0 3 310.397 4.324 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@H](c1ccccn1)C1CCC1 ZINC000598994169 1038212744 /nfs/dbraw/zinc/21/27/44/1038212744.db2.gz WVTYIZZEGCUGIQ-SMTIMMHKSA-N 0 3 323.396 4.134 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@H](c1ccccn1)C1CCC1 ZINC000598994168 1038212926 /nfs/dbraw/zinc/21/29/26/1038212926.db2.gz WVTYIZZEGCUGIQ-IUYMFKLXSA-N 0 3 323.396 4.134 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CCc2cc(Cl)ccc21 ZINC000598996150 1038215670 /nfs/dbraw/zinc/21/56/70/1038215670.db2.gz LRNTXYKKATWOGR-KRWDZBQOSA-N 0 3 316.788 4.334 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC2(CC2(F)F)CC1 ZINC000593671571 1038232870 /nfs/dbraw/zinc/23/28/70/1038232870.db2.gz KUOBRBHUXVZHCZ-UKTHLTGXSA-N 0 3 322.355 4.119 20 5 DIBDHN COc1ccc(CN(C)[C@@H](C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000061255542 1038273939 /nfs/dbraw/zinc/27/39/39/1038273939.db2.gz APWIDUXSWMHUPQ-AWEZNQCLSA-N 0 3 314.385 4.105 20 5 DIBDHN CCCN(Cc1ccccc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000603838217 1038288244 /nfs/dbraw/zinc/28/82/44/1038288244.db2.gz KLAMRPGGFDWHCD-UHFFFAOYSA-N 0 3 314.385 4.016 20 5 DIBDHN CSCCCCCCNCc1cc([N+](=O)[O-])ccc1Cl ZINC000230149779 1038538654 /nfs/dbraw/zinc/53/86/54/1038538654.db2.gz GADJXEKVJSDZIQ-UHFFFAOYSA-N 0 3 316.854 4.261 20 5 DIBDHN C[C@H](NCc1c(F)cccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000594046587 1038636292 /nfs/dbraw/zinc/63/62/92/1038636292.db2.gz WUAHEGBXBPPSLG-JTQLQIEISA-N 0 3 316.323 4.038 20 5 DIBDHN COc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1C ZINC000161792834 1039396238 /nfs/dbraw/zinc/39/62/38/1039396238.db2.gz BLDVNIJIHHASRZ-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN CCOc1cc(CN[C@@H](CC)c2cccs2)ccc1[N+](=O)[O-] ZINC000491598804 1039864750 /nfs/dbraw/zinc/86/47/50/1039864750.db2.gz KRZRIHFLLLTRIG-ZDUSSCGKSA-N 0 3 320.414 4.296 20 5 DIBDHN Cc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000235890696 1040231175 /nfs/dbraw/zinc/23/11/75/1040231175.db2.gz ABSWLODFTMNCSY-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN C[C@@H](N[C@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000173361563 1040884442 /nfs/dbraw/zinc/88/44/42/1040884442.db2.gz NOPFVJMWJMOQSM-DIFFPNOSSA-N 0 3 300.333 4.072 20 5 DIBDHN CCC1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811483419 1041521452 /nfs/dbraw/zinc/52/14/52/1041521452.db2.gz JCJNXRMJKVZVRK-UHFFFAOYSA-N 0 3 303.189 4.181 20 5 DIBDHN CC(C)=CCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811496285 1041525039 /nfs/dbraw/zinc/52/50/39/1041525039.db2.gz XJJGKEGNHOTRKD-UHFFFAOYSA-N 0 3 303.189 4.348 20 5 DIBDHN Cc1cc([C@@H](C)N[C@@H]2CCc3c2cccc3[N+](=O)[O-])ccc1F ZINC000566476441 1041669000 /nfs/dbraw/zinc/66/90/00/1041669000.db2.gz ZFOOBFGIKHRCKW-SJKOYZFVSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1cc(F)ccc1[C@H](C)NCc1cccc([N+](=O)[O-])c1C ZINC000815619035 1041975527 /nfs/dbraw/zinc/97/55/27/1041975527.db2.gz AINBLPUBDUNERK-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN C[C@H](N[C@H]1CCCc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1 ZINC000453238495 1042419025 /nfs/dbraw/zinc/41/90/25/1042419025.db2.gz QJDUWLLKKQTOAC-SGTLLEGYSA-N 0 3 314.360 4.462 20 5 DIBDHN CC(C)Oc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178642980 1043134198 /nfs/dbraw/zinc/13/41/98/1043134198.db2.gz YZSZITBMOQNCPE-CQSZACIVSA-N 0 3 314.385 4.233 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CNCc1ccc(C(F)F)cc1 ZINC000185171976 1043196229 /nfs/dbraw/zinc/19/62/29/1043196229.db2.gz YTCUVJUEKMLBPF-UHFFFAOYSA-N 0 3 306.312 4.131 20 5 DIBDHN Cc1c(CN(Cc2ccc(F)cc2)C(C)C)cccc1[N+](=O)[O-] ZINC000521220685 1043377375 /nfs/dbraw/zinc/37/73/75/1043377375.db2.gz DFMDSQFEZOFHPO-UHFFFAOYSA-N 0 3 316.376 4.453 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)CC(F)(F)F ZINC000872064275 1043445524 /nfs/dbraw/zinc/44/55/24/1043445524.db2.gz XPQDEHFBHWGLNR-RKDXNWHRSA-N 0 3 322.352 4.308 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2nc(CNC3CCCCC3)cs2)c1 ZINC000113312790 1043590466 /nfs/dbraw/zinc/59/04/66/1043590466.db2.gz QTPGBUUNZRZVKL-UHFFFAOYSA-N 0 3 317.414 4.141 20 5 DIBDHN O=[N+]([O-])c1cccc(CNC[C@@H](c2ccccc2)C(F)(F)F)c1 ZINC000186438877 1044421752 /nfs/dbraw/zinc/42/17/52/1044421752.db2.gz LKGIUDHPRYKCJY-HNNXBMFYSA-N 0 3 324.302 4.031 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCc3ccccc32)cc1Cl ZINC000783592441 1044483644 /nfs/dbraw/zinc/48/36/44/1044483644.db2.gz DSIAQJZFNCTLOS-OAHLLOKOSA-N 0 3 302.761 4.025 20 5 DIBDHN C[C@H](c1ccccc1Cl)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000523702105 1044677710 /nfs/dbraw/zinc/67/77/10/1044677710.db2.gz CBFMPPNBKZOLAK-CYBMUJFWSA-N 0 3 318.804 4.484 20 5 DIBDHN Cc1ccccc1[C@@H]1C[C@H](C)N(Cc2csc([N+](=O)[O-])c2)C1 ZINC000524595049 1044881541 /nfs/dbraw/zinc/88/15/41/1044881541.db2.gz AFVLUNZJLXJAGM-DZGCQCFKSA-N 0 3 316.426 4.343 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](N[C@@H]2CC[C@H](F)C2)c2ccccc2)c1 ZINC000577239113 1045109063 /nfs/dbraw/zinc/10/90/63/1045109063.db2.gz LXXHDARKXRNGQC-LZLYRXPVSA-N 0 3 314.360 4.164 20 5 DIBDHN Cc1scc(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])c1C ZINC000601292224 1045211389 /nfs/dbraw/zinc/21/13/89/1045211389.db2.gz MDXGZHRKHZHZKF-OAHLLOKOSA-N 0 3 302.399 4.050 20 5 DIBDHN CC[C@@H](C)N[C@@H](CNc1ccc([N+](=O)[O-])c(C)c1)c1ccco1 ZINC000557696742 1045218742 /nfs/dbraw/zinc/21/87/42/1045218742.db2.gz WCKXEDUSKXHZCI-HIFRSBDPSA-N 0 3 317.389 4.038 20 5 DIBDHN Cc1cc(Cl)ccc1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449349568 1045379849 /nfs/dbraw/zinc/37/98/49/1045379849.db2.gz QYAHHRISWMYPAE-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1 ZINC000752094316 1045658042 /nfs/dbraw/zinc/65/80/42/1045658042.db2.gz VQCFPPITKPXYIB-UHFFFAOYSA-N 0 3 314.360 4.114 20 5 DIBDHN Cc1ccccc1[C@H]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000801515103 1045728608 /nfs/dbraw/zinc/72/86/08/1045728608.db2.gz WWAHRPVEYZGFND-HNNXBMFYSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1 ZINC000453238492 1045998223 /nfs/dbraw/zinc/99/82/23/1045998223.db2.gz QJDUWLLKKQTOAC-KPZWWZAWSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1ccc([C@H](C)N2CCC[C@@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000453356665 1046055011 /nfs/dbraw/zinc/05/50/11/1046055011.db2.gz LAONBXDDAGEKMZ-WMLDXEAASA-N 0 3 320.458 4.183 20 5 DIBDHN COc1cc([C@@H](C)N[C@@H](C)c2ccc(C)s2)cc([N+](=O)[O-])c1 ZINC000903076538 1046156916 /nfs/dbraw/zinc/15/69/16/1046156916.db2.gz RRSJKRNAMFXWKP-NEPJUHHUSA-N 0 3 320.414 4.385 20 5 DIBDHN CC(C)Oc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000079723941 1046211273 /nfs/dbraw/zinc/21/12/73/1046211273.db2.gz ZGPLGFFQFRQBPO-AWEZNQCLSA-N 0 3 314.385 4.233 20 5 DIBDHN CC[C@H](N[C@H](c1ccncc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000903426916 1046275065 /nfs/dbraw/zinc/27/50/65/1046275065.db2.gz CMOJPGHQPHQZLN-ROUUACIJSA-N 0 3 311.385 4.182 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](c1ccncc1)C1CC1 ZINC000903430057 1046279156 /nfs/dbraw/zinc/27/91/56/1046279156.db2.gz XJCXSUCWKMNNKL-FZKQIMNGSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1c([C@@H](C)N[C@H](c2ccncc2)C2CC2)cccc1[N+](=O)[O-] ZINC000903430060 1046279691 /nfs/dbraw/zinc/27/96/91/1046279691.db2.gz XJMDVIDSIWQTRZ-ACJLOTCBSA-N 0 3 311.385 4.100 20 5 DIBDHN CC[C@H](NCc1ccc(C)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090224727 1046350116 /nfs/dbraw/zinc/35/01/16/1046350116.db2.gz HSTDHUGQYDOATO-KRWDZBQOSA-N 0 3 302.349 4.283 20 5 DIBDHN Cc1cc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1F ZINC000610804637 1046372520 /nfs/dbraw/zinc/37/25/20/1046372520.db2.gz SFBREESZSUGIQY-OLZOCXBDSA-N 0 3 302.349 4.454 20 5 DIBDHN Cc1c(CN[C@@H](c2cccs2)C2CC2)cccc1[N+](=O)[O-] ZINC000224106091 1046424556 /nfs/dbraw/zinc/42/45/56/1046424556.db2.gz IAWYXBUYBWUBNK-MRXNPFEDSA-N 0 3 302.399 4.206 20 5 DIBDHN CN(Cc1cnccn1)Cc1c2ccccc2cc2ccccc21 ZINC000092591271 1046533482 /nfs/dbraw/zinc/53/34/82/1046533482.db2.gz XXKNXBMDUKSECX-UHFFFAOYSA-N 0 3 313.404 4.415 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)NCc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782543733 1046536600 /nfs/dbraw/zinc/53/66/00/1046536600.db2.gz OHCSVFOBTCRNJF-NSHDSACASA-N 0 3 324.730 4.315 20 5 DIBDHN Cc1cccc([C@H]2CCN(Cc3cc(F)ccc3[N+](=O)[O-])C2)c1 ZINC000784481211 1046691140 /nfs/dbraw/zinc/69/11/40/1046691140.db2.gz LKMZDKLGHDFLOU-HNNXBMFYSA-N 0 3 314.360 4.032 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C1CC1)C1CCCC1 ZINC000303296464 1046906016 /nfs/dbraw/zinc/90/60/16/1046906016.db2.gz XZLXNHYDBBFSDO-UHFFFAOYSA-N 0 3 318.417 4.289 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1c2ccccc2C[C@H]1C ZINC000536873415 1047116947 /nfs/dbraw/zinc/11/69/47/1047116947.db2.gz ZYOUNLPHKSXSAU-BIENJYKASA-N 0 3 310.397 4.487 20 5 DIBDHN CO[C@@H]1CN(Cc2c3ccccc3cc3ccccc32)C[C@@H]1F ZINC001141723421 1047278483 /nfs/dbraw/zinc/27/84/83/1047278483.db2.gz XABDLKGBPIECOB-VQTJNVASSA-N 0 3 309.384 4.162 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2CN1C[C@H]2CC[C@@H]1CO2 ZINC001141728311 1047281302 /nfs/dbraw/zinc/28/13/02/1047281302.db2.gz QEESHLFOZVMLOS-QZTJIDSGSA-N 0 3 303.405 4.356 20 5 DIBDHN Cc1ccccc1[C@@H]1CCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000725804137 1047317638 /nfs/dbraw/zinc/31/76/38/1047317638.db2.gz IXEGMGZYTSAKRD-CQSZACIVSA-N 0 3 314.360 4.032 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCCc3ccccc32)cc1[N+](=O)[O-] ZINC000725851984 1047321411 /nfs/dbraw/zinc/32/14/11/1047321411.db2.gz BVCBLJXAFZCTSB-SFHVURJKSA-N 0 3 310.397 4.461 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCCCc3ccccc32)cc1[N+](=O)[O-] ZINC000725851981 1047321593 /nfs/dbraw/zinc/32/15/93/1047321593.db2.gz BVCBLJXAFZCTSB-GOSISDBHSA-N 0 3 310.397 4.461 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H](c1cccnc1)C1CC1 ZINC000539051929 1047727383 /nfs/dbraw/zinc/72/73/83/1047727383.db2.gz PULUJLDFHZVBDA-FZKQIMNGSA-N 0 3 311.385 4.100 20 5 DIBDHN C[C@@H](N[C@@H]1CCSC2(CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000927035437 1047766185 /nfs/dbraw/zinc/76/61/85/1047766185.db2.gz GPIRTKRTLCGXMF-VXGBXAGGSA-N 0 3 324.421 4.203 20 5 DIBDHN C[C@@H](NCc1cc([N+](=O)[O-])ccc1Cl)C(C)(C)C(F)F ZINC000850443115 1048657651 /nfs/dbraw/zinc/65/76/51/1048657651.db2.gz AXGGBSGVPDQWNG-MRVPVSSYSA-N 0 3 306.740 4.018 20 5 DIBDHN COc1ccc(Nc2ccnc(C(C)(C)C)c2)cc1[N+](=O)[O-] ZINC001176361243 1048659465 /nfs/dbraw/zinc/65/94/65/1048659465.db2.gz UHWDCPKWOVWHDK-UHFFFAOYSA-N 0 3 301.346 4.040 20 5 DIBDHN C[C@H](NCc1ccc2scnc2c1)c1cccc([N+](=O)[O-])c1 ZINC001177328111 1048870641 /nfs/dbraw/zinc/87/06/41/1048870641.db2.gz HUCKTXCOZMRRFC-NSHDSACASA-N 0 3 313.382 4.055 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)CN(CC[C@@H]1CCc3ccccc31)CC2 ZINC001191520688 1048958561 /nfs/dbraw/zinc/95/85/61/1048958561.db2.gz JNZOBBHTKPYIJR-KRWDZBQOSA-N 0 3 322.408 4.073 20 5 DIBDHN Cc1ccc(Cl)cc1CNCc1cccc([N+](=O)[O-])c1C ZINC001203934818 1049034664 /nfs/dbraw/zinc/03/46/64/1049034664.db2.gz HDQPOJXUQPJVEA-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN C[C@@H](CCCC(F)(F)F)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000775528507 1049107849 /nfs/dbraw/zinc/10/78/49/1049107849.db2.gz YYXDXXYPMVTBAB-VIFPVBQESA-N 0 3 324.730 4.459 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCS[C@@H](C(C)C)C1 ZINC001204681215 1049222303 /nfs/dbraw/zinc/22/23/03/1049222303.db2.gz ITYWLQUBJOKAGV-RKCSUWQLSA-N 0 3 320.458 4.072 20 5 DIBDHN CC[C@@H](CN(CC)Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC001193593169 1049230143 /nfs/dbraw/zinc/23/01/43/1049230143.db2.gz JPMDXIHWFHAKMF-HNNXBMFYSA-N 0 3 313.401 4.006 20 5 DIBDHN CCCC1CCC(N(C)Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC001194051287 1049308876 /nfs/dbraw/zinc/30/88/76/1049308876.db2.gz BDBVYTUHAIGYEI-UHFFFAOYSA-N 0 3 320.433 4.394 20 5 DIBDHN COc1ccc(CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000485820387 1049347817 /nfs/dbraw/zinc/34/78/17/1049347817.db2.gz WIFCJBOQRLYTFO-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN COc1ccc(CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000485820386 1049347950 /nfs/dbraw/zinc/34/79/50/1049347950.db2.gz WIFCJBOQRLYTFO-AWEZNQCLSA-N 0 3 314.385 4.105 20 5 DIBDHN CC1(CNCc2nc3cc([N+](=O)[O-])ccc3o2)CCCCCC1 ZINC001205077602 1049366892 /nfs/dbraw/zinc/36/68/92/1049366892.db2.gz PSRRRNCNFQCFDK-UHFFFAOYSA-N 0 3 317.389 4.186 20 5 DIBDHN CCC[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)C(C)(C)C ZINC001194425159 1049372650 /nfs/dbraw/zinc/37/26/50/1049372650.db2.gz ABVQEZSFYZMEFD-CQSZACIVSA-N 0 3 300.349 4.177 20 5 DIBDHN CC[C@@H]1CCCC[C@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001206055734 1049642448 /nfs/dbraw/zinc/64/24/48/1049642448.db2.gz MBSRRLLURPRULW-OLZOCXBDSA-N 0 3 317.389 4.042 20 5 DIBDHN Cc1ccc(CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000489141073 1049729207 /nfs/dbraw/zinc/72/92/07/1049729207.db2.gz RPERMJKSSPEXBF-CYBMUJFWSA-N 0 3 304.415 4.466 20 5 DIBDHN C[C@H](NCc1ccc2c(c1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000490577274 1049842700 /nfs/dbraw/zinc/84/27/00/1049842700.db2.gz FYPJYABHNZUNDR-AWEZNQCLSA-N 0 3 310.397 4.324 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1cccc(Cl)c1 ZINC000572303009 1050000090 /nfs/dbraw/zinc/00/00/90/1050000090.db2.gz WMYXRYKCJQNSAX-OAHLLOKOSA-N 0 3 302.761 4.025 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)C[C@@H]1CC=CCC1 ZINC001168401223 1050235572 /nfs/dbraw/zinc/23/55/72/1050235572.db2.gz GXYMIXLETVXQTL-OAHLLOKOSA-N 0 3 318.417 4.170 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@]2(CC2(F)F)C1 ZINC000844441403 1050426985 /nfs/dbraw/zinc/42/69/85/1050426985.db2.gz MRLKCSHFHJGCIJ-WFASDCNBSA-N 0 3 310.344 4.085 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC[C@]3(CC=CCC3)C2)cc1F ZINC000788481000 1050687041 /nfs/dbraw/zinc/68/70/41/1050687041.db2.gz NOIAKOXDJLFNRO-QGZVFWFLSA-N 0 3 304.365 4.056 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788496701 1050692047 /nfs/dbraw/zinc/69/20/47/1050692047.db2.gz AOKNYUFQOQIGKT-WDEREUQCSA-N 0 3 319.792 4.242 20 5 DIBDHN Cc1ccc(CC[C@H](C)NCc2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000742379501 1050840628 /nfs/dbraw/zinc/84/06/28/1050840628.db2.gz CWLNYIGFZVJJCI-NSHDSACASA-N 0 3 322.792 4.261 20 5 DIBDHN CCCN(CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1F ZINC001169032499 1051491733 /nfs/dbraw/zinc/49/17/33/1051491733.db2.gz JDIVMHMPFGXRSL-UHFFFAOYSA-N 0 3 322.405 4.250 20 5 DIBDHN Cc1cc(C)c(CNCc2ccc([N+](=O)[O-])c(Cl)c2)c(C)c1 ZINC000761522942 1051585015 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ZINC001217796326 1052145592 /nfs/dbraw/zinc/14/55/92/1052145592.db2.gz YQMMEMYEHFKPGL-VQTJNVASSA-N 0 3 309.384 4.210 20 5 DIBDHN FC1(F)CCNC[C@H]1Oc1c2ccccc2cc2ccccc21 ZINC001218450958 1052239778 /nfs/dbraw/zinc/23/97/78/1052239778.db2.gz ATXPXFFZPBAGHA-QGZVFWFLSA-N 0 3 313.347 4.369 20 5 DIBDHN FC1(F)CCNC[C@H]1Oc1ccc2cc3ccccc3cc2c1 ZINC001218453671 1052241232 /nfs/dbraw/zinc/24/12/32/1052241232.db2.gz ZUBHFIZCXIDACM-GOSISDBHSA-N 0 3 313.347 4.369 20 5 DIBDHN FC1(F)CCNC[C@@H]1Oc1ccc2cc3ccccc3cc2c1 ZINC001218453672 1052241385 /nfs/dbraw/zinc/24/13/85/1052241385.db2.gz ZUBHFIZCXIDACM-SFHVURJKSA-N 0 3 313.347 4.369 20 5 DIBDHN COc1cc(C)cc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000090723721 1052534029 /nfs/dbraw/zinc/53/40/29/1052534029.db2.gz ATDUKPPJPWUOKW-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN COc1cc(C)cc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000090723722 1052534050 /nfs/dbraw/zinc/53/40/50/1052534050.db2.gz ATDUKPPJPWUOKW-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN COc1cc(C)cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000090723774 1052534768 /nfs/dbraw/zinc/53/47/68/1052534768.db2.gz CHGSCYRPTLYXBY-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN COc1cc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1C ZINC000161786469 1052573226 /nfs/dbraw/zinc/57/32/26/1052573226.db2.gz NPSVJSCDMGVPGB-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)Cc1ccsc1 ZINC000615833469 1053032546 /nfs/dbraw/zinc/03/25/46/1053032546.db2.gz MGNISZAKMCHMKP-JYRVWZFOSA-N 0 3 302.399 4.192 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H]1CCc3ccccc31)CCC2 ZINC000618562199 1053323381 /nfs/dbraw/zinc/32/33/81/1053323381.db2.gz HXJPFVYXYCHWTB-OALUTQOASA-N 0 3 308.381 4.249 20 5 DIBDHN Cc1ccncc1[C@H](C)N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571383 1053324653 /nfs/dbraw/zinc/32/46/53/1053324653.db2.gz HEQSBXAURNXGSZ-SCLBCKFNSA-N 0 3 311.385 4.026 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000618565252 1053325759 /nfs/dbraw/zinc/32/57/59/1053325759.db2.gz MGMGBEQWLYRCAF-INIZCTEOSA-N 0 3 302.399 4.132 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc3c(c1)CCC3)CCC2 ZINC001321282058 1053405255 /nfs/dbraw/zinc/40/52/55/1053405255.db2.gz IMXVYZZTDNOFEA-FQEVSTJZSA-N 0 3 322.408 4.251 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccccc2CF)cc1[N+](=O)[O-] ZINC001335613650 1054221486 /nfs/dbraw/zinc/22/14/86/1054221486.db2.gz PMXDPCQUEYPGPI-ZDUSSCGKSA-N 0 3 302.349 4.224 20 5 DIBDHN NCc1cc(-c2ccc3ccc4cccc5ccc2c3c45)ncn1 ZINC001236378053 1055082087 /nfs/dbraw/zinc/08/20/87/1055082087.db2.gz GBUIEEJQRRFAOW-UHFFFAOYSA-N 0 3 309.372 4.500 20 5 DIBDHN CC[C@@H](C)N[C@@H](CNc1cc(C)ccc1[N+](=O)[O-])c1ccco1 ZINC001612367591 1056278868 /nfs/dbraw/zinc/27/88/68/1056278868.db2.gz HMEDZCVRZCFPGZ-HIFRSBDPSA-N 0 3 317.389 4.038 20 5 DIBDHN CC[C@H](C)N[C@H](CNc1cc(C)sc1[N+](=O)[O-])c1ccco1 ZINC001612367582 1056279514 /nfs/dbraw/zinc/27/95/14/1056279514.db2.gz HHLXIUBPNLQGOU-GXFFZTMASA-N 0 3 323.418 4.099 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@H]1CCC[C@H](C)C1 ZINC001615302740 1056489809 /nfs/dbraw/zinc/48/98/09/1056489809.db2.gz JOGUBQJUVNWETD-HOCLYGCPSA-N 0 3 320.433 4.393 20 5 DIBDHN C[C@]1(CCc2ccccc2)CCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC001615806291 1056577939 /nfs/dbraw/zinc/57/79/39/1056577939.db2.gz QNVHMCAOZNEZCL-FQEVSTJZSA-N 0 3 324.424 4.440 20 5 DIBDHN c1ccc2c(c1)cc(-c1ncnc3c1CCNC3)c1ccccc21 ZINC001241133180 1056915979 /nfs/dbraw/zinc/91/59/79/1056915979.db2.gz UCMPTOIMLRSUPN-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN Cc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc2n1 ZINC000171762449 1057241091 /nfs/dbraw/zinc/24/10/91/1057241091.db2.gz CGCQEZWQAFVAFC-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]1c1ccc(O)cc1 ZINC000611265467 1057587287 /nfs/dbraw/zinc/58/72/87/1057587287.db2.gz SSTWOYIHGTXBGI-PXPSOEEZSA-N 0 3 324.380 4.151 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CC=CCC2)s1 ZINC000611521128 1057605174 /nfs/dbraw/zinc/60/51/74/1057605174.db2.gz CISRIQKNFCNUGL-UHFFFAOYSA-N 0 3 300.383 4.085 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1C(C)C ZINC001559540995 1059343573 /nfs/dbraw/zinc/34/35/73/1059343573.db2.gz FURMILPNHPUHJH-QGZVFWFLSA-N 0 3 320.433 4.393 20 5 DIBDHN CCC1CCC(N(C)Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC001559583260 1059414583 /nfs/dbraw/zinc/41/45/83/1059414583.db2.gz BMCZHUKLRIPZBF-UHFFFAOYSA-N 0 3 306.406 4.004 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@@H](C3CCCC3)C2)c1 ZINC001559924760 1059739091 /nfs/dbraw/zinc/73/90/91/1059739091.db2.gz BTQNZBKLFCFHLK-CYBMUJFWSA-N 0 3 308.809 4.260 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@@H](C2CCCC2)C1 ZINC001559925506 1059741511 /nfs/dbraw/zinc/74/15/11/1059741511.db2.gz VAHWJIMLXMBGPL-CYBMUJFWSA-N 0 3 308.809 4.260 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CC[C@]1(C)C1CCCCC1 ZINC001560095438 1059901812 /nfs/dbraw/zinc/90/18/12/1059901812.db2.gz ABYLIMNVNSGCMT-GOSISDBHSA-N 0 3 318.417 4.148 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc3[nH]ccc3c2)cc1[N+](=O)[O-] ZINC001560357058 1060142051 /nfs/dbraw/zinc/14/20/51/1060142051.db2.gz DEQYWELPVNDRPW-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN Cc1c(CN2CC([C@H]3CCC[C@@H](C)C3)C2)cccc1[N+](=O)[O-] ZINC001560977762 1060841805 /nfs/dbraw/zinc/84/18/05/1060841805.db2.gz JSPLBKBJOZAVBN-HIFRSBDPSA-N 0 3 302.418 4.161 20 5 DIBDHN C=C/C=C/CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001560990221 1060853734 /nfs/dbraw/zinc/85/37/34/1060853734.db2.gz UFIGKSDBHCNRMV-ONEGZZNKSA-N 0 3 301.173 4.124 20 5 DIBDHN O=[N+]([O-])c1ncccc1CN1CCC[C@H]1CCC1CCCCC1 ZINC001473279046 1061051583 /nfs/dbraw/zinc/05/15/83/1061051583.db2.gz QXDDWNGYXDMMCK-KRWDZBQOSA-N 0 3 317.433 4.315 20 5 DIBDHN Cc1cccc(C2=CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001473309713 1061075801 /nfs/dbraw/zinc/07/58/01/1061075801.db2.gz BJBZHTGUMJFGIN-UHFFFAOYSA-N 0 3 322.408 4.235 20 5 DIBDHN CCN(Cc1cc([N+](=O)[O-])ccc1OC(C)C)CC(C)(C)C ZINC001473500564 1061193080 /nfs/dbraw/zinc/19/30/80/1061193080.db2.gz FNNMUHXQCAZGMV-UHFFFAOYSA-N 0 3 308.422 4.250 20 5 DIBDHN CCC[C@@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001473857863 1061436290 /nfs/dbraw/zinc/43/62/90/1061436290.db2.gz DWIVDBRNWBHEKP-OAHLLOKOSA-N 0 3 315.373 4.014 20 5 DIBDHN CCC[C@H]1CCCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001473859006 1061437078 /nfs/dbraw/zinc/43/70/78/1061437078.db2.gz ARLGAJPLQNQUPJ-HNNXBMFYSA-N 0 3 306.406 4.147 20 5 DIBDHN C[C@@H](CNCc1c(F)cccc1Cl)c1ccccc1[N+](=O)[O-] ZINC001474283986 1061853366 /nfs/dbraw/zinc/85/33/66/1061853366.db2.gz XSFHEMLFGLBVRC-NSHDSACASA-N 0 3 322.767 4.281 20 5 DIBDHN CC(C)C[C@H]1CCCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001459420666 1062138422 /nfs/dbraw/zinc/13/84/22/1062138422.db2.gz UAVPBILEANSXNV-MRXNPFEDSA-N 0 3 320.433 4.393 20 5 DIBDHN CC(C)C[C@@H]1CCCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001459420664 1062138783 /nfs/dbraw/zinc/13/87/83/1062138783.db2.gz UAVPBILEANSXNV-INIZCTEOSA-N 0 3 320.433 4.393 20 5 DIBDHN Cc1ccc(CC2CCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC001459802900 1062410815 /nfs/dbraw/zinc/41/08/15/1062410815.db2.gz DAKCOPYAIUQSKC-UHFFFAOYSA-N 0 3 324.424 4.358 20 5 DIBDHN Cc1cc(C)cc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001459884229 1062471781 /nfs/dbraw/zinc/47/17/81/1062471781.db2.gz OZSNVGYPQXPSEN-UHFFFAOYSA-N 0 3 310.397 4.376 20 5 DIBDHN CC1(C)CN(CCc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC001460207561 1062699926 /nfs/dbraw/zinc/69/99/26/1062699926.db2.gz VDSORYWJDUPAOF-INIZCTEOSA-N 0 3 316.426 4.282 20 5 DIBDHN CCc1ccc(CNCc2c(C)ccc([N+](=O)[O-])c2C)s1 ZINC001461045303 1063212059 /nfs/dbraw/zinc/21/20/59/1063212059.db2.gz RWNDHUHOECEHNS-UHFFFAOYSA-N 0 3 304.415 4.125 20 5 DIBDHN CC[C@@H](NCc1cccc2c1CCC2)c1cccc([N+](=O)[O-])c1 ZINC001461355040 1063436986 /nfs/dbraw/zinc/43/69/86/1063436986.db2.gz OPCUFUMAKCEXCQ-LJQANCHMSA-N 0 3 310.397 4.324 20 5 DIBDHN Cc1ccccc1[C@@H]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001307443326 1065404062 /nfs/dbraw/zinc/40/40/62/1065404062.db2.gz BANNLDFLWOYMFM-CQSZACIVSA-N 0 3 314.360 4.032 20 5 DIBDHN Cc1ccc(CN[C@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001307635551 1065532601 /nfs/dbraw/zinc/53/26/01/1065532601.db2.gz OBVQCGMSVMUEKO-CQSZACIVSA-N 0 3 310.397 4.243 20 5 DIBDHN Cc1ccc([C@H](C)CN2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC001308629917 1066126125 /nfs/dbraw/zinc/12/61/25/1066126125.db2.gz NSEJDLWOUFHQRD-OAHLLOKOSA-N 0 3 310.397 4.065 20 5 DIBDHN C[C@@H]1CC(C)(C)CN1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001308821993 1066297178 /nfs/dbraw/zinc/29/71/78/1066297178.db2.gz YBKXKWFIZLZKHR-SNVBAGLBSA-N 0 3 316.323 4.234 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@H]2C2CCC2)cc1Cl ZINC001308852105 1066331925 /nfs/dbraw/zinc/33/19/25/1066331925.db2.gz VFFAIBXPOHZLCU-HNNXBMFYSA-N 0 3 308.809 4.403 20 5 DIBDHN CCCCO[C@@H]1C[C@@H](N[C@@H](C)c2ccccc2[N+](=O)[O-])C1(C)C ZINC001308928868 1066403493 /nfs/dbraw/zinc/40/34/93/1066403493.db2.gz MNYBZKGAZHHRMF-IAOVAPTHSA-N 0 3 320.433 4.229 20 5 DIBDHN CCCCO[C@@H]1C[C@H](N[C@@H](C)c2ccccc2[N+](=O)[O-])C1(C)C ZINC001308928870 1066403620 /nfs/dbraw/zinc/40/36/20/1066403620.db2.gz MNYBZKGAZHHRMF-RRQGHBQHSA-N 0 3 320.433 4.229 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(OCC(C)C)CC1 ZINC000182682245 335000265 /nfs/dbraw/zinc/00/02/65/335000265.db2.gz LDQSTAOGMMRGIT-HNNXBMFYSA-N 0 3 320.433 4.101 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2sccc21)c1ccc([N+](=O)[O-])cc1 ZINC000061359969 184168683 /nfs/dbraw/zinc/16/86/83/184168683.db2.gz XKBFJSKLYFGYKP-XHDPSFHLSA-N 0 3 302.399 4.385 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000297361760 533111197 /nfs/dbraw/zinc/11/11/97/533111197.db2.gz PVJIOKVQPOEAOB-QWHCGFSZSA-N 0 3 300.358 4.015 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000297361765 533172770 /nfs/dbraw/zinc/17/27/70/533172770.db2.gz PVJIOKVQPOEAOB-STQMWFEESA-N 0 3 300.358 4.015 20 5 DIBDHN Cc1nc2c(s1)[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000297283845 132007919 /nfs/dbraw/zinc/00/79/19/132007919.db2.gz LKTJFFAOSPCNLZ-IINYFYTJSA-N 0 3 317.414 4.088 20 5 DIBDHN COc1cccc([C@@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000119649413 132135247 /nfs/dbraw/zinc/13/52/47/132135247.db2.gz VBSIVVHMHXQFFI-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN COc1cccc([C@H](C)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000119649083 132135357 /nfs/dbraw/zinc/13/53/57/132135357.db2.gz VBSIVVHMHXQFFI-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1ccc(CN[C@@H](C)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000035009651 331465596 /nfs/dbraw/zinc/46/55/96/331465596.db2.gz JZVSEUJAYMQKQT-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN CC[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000035055403 331467649 /nfs/dbraw/zinc/46/76/49/331467649.db2.gz YWWVYDZSILMDPB-INIZCTEOSA-N 0 3 304.777 4.489 20 5 DIBDHN CC[C@H](N[C@H](C)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000090918544 331917856 /nfs/dbraw/zinc/91/78/56/331917856.db2.gz CAFZSWVLEJLNOE-ACJLOTCBSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@@H](Cc1ccsc1)NC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000562387040 332588328 /nfs/dbraw/zinc/58/83/28/332588328.db2.gz AKJWKWXKESCBFT-LBPRGKRZSA-N 0 3 304.415 4.112 20 5 DIBDHN C[C@H](NCc1ccc(C(F)F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000178665696 333018255 /nfs/dbraw/zinc/01/82/55/333018255.db2.gz VYELCXGBZGHPBH-NSHDSACASA-N 0 3 306.312 4.383 20 5 DIBDHN Cc1c(CN[C@H]2CCc3cc(Cl)ccc32)cccc1[N+](=O)[O-] ZINC000318666659 333200628 /nfs/dbraw/zinc/20/06/28/333200628.db2.gz YSNCUIWXLSBLBV-INIZCTEOSA-N 0 3 316.788 4.334 20 5 DIBDHN CCC[C@@H](NCCc1csc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000319043446 333249255 /nfs/dbraw/zinc/24/92/55/333249255.db2.gz AWUKUXFKGXLCOK-MRXNPFEDSA-N 0 3 319.430 4.033 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000062726449 333336126 /nfs/dbraw/zinc/33/61/26/333336126.db2.gz GFOXWQDNTFDRSI-GFCCVEGCSA-N 0 3 304.777 4.142 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000062726448 333336220 /nfs/dbraw/zinc/33/62/20/333336220.db2.gz GFOXWQDNTFDRSI-LBPRGKRZSA-N 0 3 304.777 4.142 20 5 DIBDHN Cc1c([C@H](C)NCCCOc2ccccc2)cccc1[N+](=O)[O-] ZINC000531945879 334301083 /nfs/dbraw/zinc/30/10/83/334301083.db2.gz KZFJFNDRHYHUAW-HNNXBMFYSA-N 0 3 314.385 4.023 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCCc1cc(F)ccc1F ZINC000531994888 334369328 /nfs/dbraw/zinc/36/93/28/334369328.db2.gz LUEGEORRZYNHPH-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCc1cc(F)ccc1F ZINC000531994887 334369396 /nfs/dbraw/zinc/36/93/96/334369396.db2.gz LUEGEORRZYNHPH-GFCCVEGCSA-N 0 3 320.339 4.075 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccsc1)CCCC2 ZINC000417333308 334709368 /nfs/dbraw/zinc/70/93/68/334709368.db2.gz YTMCAMTYBNTKKK-MRXNPFEDSA-N 0 3 302.399 4.214 20 5 DIBDHN CCOc1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000532207290 335917752 /nfs/dbraw/zinc/91/77/52/335917752.db2.gz KLZYMIYHLNUCFS-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN CC[C@H](N[C@@H](C)c1sc(C)nc1C)c1cccc([N+](=O)[O-])c1 ZINC000194384457 338516989 /nfs/dbraw/zinc/51/69/89/338516989.db2.gz HVMUQXJRQYNQLF-NHYWBVRUSA-N 0 3 319.430 4.470 20 5 DIBDHN Cc1cc(N2CCc3c(cccc3[N+](=O)[O-])C2)c2ccccc2n1 ZINC000301807324 336331430 /nfs/dbraw/zinc/33/14/30/336331430.db2.gz CDZZLPYSKIFRBD-UHFFFAOYSA-N 0 3 319.364 4.014 20 5 DIBDHN CCc1cnccc1[C@H](C)N[C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000359315260 336667274 /nfs/dbraw/zinc/66/72/74/336667274.db2.gz SFGHROWYKKYOHH-SCLBCKFNSA-N 0 3 313.401 4.354 20 5 DIBDHN CC1(C)CC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000583314841 337314126 /nfs/dbraw/zinc/31/41/26/337314126.db2.gz WAHAZVNHDXGELC-INIZCTEOSA-N 0 3 300.358 4.133 20 5 DIBDHN CSC[C@H]1CCCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000430200285 338101139 /nfs/dbraw/zinc/10/11/39/338101139.db2.gz UGCCMBJFTYATOY-MBSJSRAVSA-N 0 3 320.458 4.073 20 5 DIBDHN Cc1ccc(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000433160698 338183473 /nfs/dbraw/zinc/18/34/73/338183473.db2.gz HYNLGPBGPCSOTL-GOSISDBHSA-N 0 3 310.397 4.415 20 5 DIBDHN C[C@H](NCc1cc2c(cccc2F)[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000436274160 338264877 /nfs/dbraw/zinc/26/48/77/338264877.db2.gz KQPFJSZBNUEOAF-NSHDSACASA-N 0 3 313.332 4.066 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000437099224 338300783 /nfs/dbraw/zinc/30/07/83/338300783.db2.gz QKNLIOHXRGUWAK-GWCFXTLKSA-N 0 3 304.312 4.222 20 5 DIBDHN C[C@H]1CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)c2sccc21 ZINC000453138553 338798509 /nfs/dbraw/zinc/79/85/09/338798509.db2.gz AOQHHXCCZFQMCN-XHDPSFHLSA-N 0 3 302.399 4.385 20 5 DIBDHN CO[C@H](c1ccccc1)[C@@H](C)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000453250758 338814299 /nfs/dbraw/zinc/81/42/99/338814299.db2.gz YZHPRRRIZQMDRT-IYOUNJFTSA-N 0 3 314.385 4.022 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H](C)c1ccc(Cl)cc1 ZINC000459774093 339047789 /nfs/dbraw/zinc/04/77/89/339047789.db2.gz VZPSYHHNORAXTR-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN CCS[C@@H]1CC[C@@H](N(C)Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000464781278 339153407 /nfs/dbraw/zinc/15/34/07/339153407.db2.gz XXAPCKZLKPPIAX-HUUCEWRRSA-N 0 3 308.447 4.009 20 5 DIBDHN Cc1ccccc1[C@H]1C[C@H](NCc2csc([N+](=O)[O-])c2)C1 ZINC000466402663 339202721 /nfs/dbraw/zinc/20/27/21/339202721.db2.gz ZJWFKPXFKMKXBO-HDJSIYSDSA-N 0 3 302.399 4.001 20 5 DIBDHN C[C@@H](NCCSCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000467847422 339247596 /nfs/dbraw/zinc/24/75/96/339247596.db2.gz YBUJXFUXXGMWSJ-CQSZACIVSA-N 0 3 316.426 4.179 20 5 DIBDHN CC[C@H](NCCc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000468000658 339250900 /nfs/dbraw/zinc/25/09/00/339250900.db2.gz QVCGEMORRKKDIO-INIZCTEOSA-N 0 3 320.339 4.156 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc2ccccc2n1 ZINC000468010417 339251108 /nfs/dbraw/zinc/25/11/08/339251108.db2.gz XZQZEGPMFZZULP-CQSZACIVSA-N 0 3 321.380 4.036 20 5 DIBDHN CCS[C@H]1CCCCN([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468229968 339256779 /nfs/dbraw/zinc/25/67/79/339256779.db2.gz JKFYTNXDIMGOAI-KBPBESRZSA-N 0 3 308.447 4.263 20 5 DIBDHN CCS[C@@H]1CCCC[C@H]1N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000469794235 339300429 /nfs/dbraw/zinc/30/04/29/339300429.db2.gz OHTVLQQDILGETK-XNRPHZJLSA-N 0 3 308.447 4.310 20 5 DIBDHN Cc1ccc(SC[C@@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000472149585 339364422 /nfs/dbraw/zinc/36/44/22/339364422.db2.gz AASGVENCJZMCOO-CQSZACIVSA-N 0 3 316.426 4.174 20 5 DIBDHN O=[N+]([O-])c1cc(CNC2(Cc3cccc(F)c3)CCC2)cs1 ZINC000479878149 339552429 /nfs/dbraw/zinc/55/24/29/339552429.db2.gz ZKVMCJDMBNMHQA-UHFFFAOYSA-N 0 3 320.389 4.050 20 5 DIBDHN Cc1cccc(OC[C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000481033031 339593710 /nfs/dbraw/zinc/59/37/10/339593710.db2.gz FUAHJHKITZAUPT-CABCVRRESA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1c([C@H](C)NCCc2cc(F)ccc2F)cccc1[N+](=O)[O-] ZINC000484488947 339687695 /nfs/dbraw/zinc/68/76/95/339687695.db2.gz VSYIAACELXXCKD-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN C[C@H](NCCCc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000492781984 339908684 /nfs/dbraw/zinc/90/86/84/339908684.db2.gz FKFQMYGPZZDKGJ-ZDUSSCGKSA-N 0 3 302.349 4.017 20 5 DIBDHN CCC[C@H](NCc1ccc([N+](=O)[O-])c(OC)c1)c1ccccc1 ZINC000493008790 339914788 /nfs/dbraw/zinc/91/47/88/339914788.db2.gz LIKYMSLFBMSMKY-INIZCTEOSA-N 0 3 314.385 4.234 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC[C@H]2CCCC(F)(F)C2)c(Cl)c1 ZINC000500357518 340055638 /nfs/dbraw/zinc/05/56/38/340055638.db2.gz KGYXFOFESGECLJ-JTQLQIEISA-N 0 3 318.751 4.163 20 5 DIBDHN Cc1c(CN2CC[C@@H](c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000503709579 340134017 /nfs/dbraw/zinc/13/40/17/340134017.db2.gz QCNPNMKRLMFTBR-OAHLLOKOSA-N 0 3 314.360 4.032 20 5 DIBDHN Cc1c2ccccc2n(C)c1CN[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000479459600 340151866 /nfs/dbraw/zinc/15/18/66/340151866.db2.gz XUAMNHBAFOSTTM-AWEZNQCLSA-N 0 3 323.396 4.246 20 5 DIBDHN CC(C)N(Cc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000506831496 340202376 /nfs/dbraw/zinc/20/23/76/340202376.db2.gz YMMKSWQPVPIBLJ-UHFFFAOYSA-N 0 3 302.349 4.145 20 5 DIBDHN Cc1ccc(CN(Cc2cccs2)C(C)C)cc1[N+](=O)[O-] ZINC000507021567 340205600 /nfs/dbraw/zinc/20/56/00/340205600.db2.gz NXYNEDXJRBIVPJ-UHFFFAOYSA-N 0 3 304.415 4.375 20 5 DIBDHN CC[C@H](CNCc1ccc([N+](=O)[O-])cc1Cl)CC(F)(F)F ZINC000402563239 340243077 /nfs/dbraw/zinc/24/30/77/340243077.db2.gz LAJNVHLLLXJYAW-VIFPVBQESA-N 0 3 324.730 4.316 20 5 DIBDHN CCN(C/C=C\c1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000508708717 340251185 /nfs/dbraw/zinc/25/11/85/340251185.db2.gz DXHSUKPTSZINBI-YVMONPNESA-N 0 3 316.426 4.234 20 5 DIBDHN C[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)[C@H](C)c1ccccc1 ZINC000509009151 340258054 /nfs/dbraw/zinc/25/80/54/340258054.db2.gz XTXKYGKBSAOLAQ-NWDGAFQWSA-N 0 3 320.339 4.155 20 5 DIBDHN C[C@@H](C1CC1)N(Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000302834769 340283301 /nfs/dbraw/zinc/28/33/01/340283301.db2.gz WRHGYJNZHXULBP-HNNXBMFYSA-N 0 3 310.397 4.396 20 5 DIBDHN C[C@H](C1CC1)N(Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000302834770 340283366 /nfs/dbraw/zinc/28/33/66/340283366.db2.gz WRHGYJNZHXULBP-OAHLLOKOSA-N 0 3 310.397 4.396 20 5 DIBDHN CN(CCc1ccc2ccccc2c1)Cc1ccccc1[N+](=O)[O-] ZINC000511641561 340333585 /nfs/dbraw/zinc/33/35/85/340333585.db2.gz UMPVYZRVTBTIEH-UHFFFAOYSA-N 0 3 320.392 4.423 20 5 DIBDHN C[C@H]1CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000513073589 340392149 /nfs/dbraw/zinc/39/21/49/340392149.db2.gz CRCGPPJUBMVDLD-ZUZCIYMTSA-N 0 3 320.776 4.396 20 5 DIBDHN Cc1cc2cc(CNC/C=C\c3ccccc3[N+](=O)[O-])ccc2[nH]1 ZINC000513094310 340393084 /nfs/dbraw/zinc/39/30/84/340393084.db2.gz HKYXUUUFCGOWML-XQRVVYSFSA-N 0 3 321.380 4.188 20 5 DIBDHN C[C@H](N[C@@H]1CCCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000089214365 340466566 /nfs/dbraw/zinc/46/65/66/340466566.db2.gz DZNUZUHZUOTFQP-KPZWWZAWSA-N 0 3 314.360 4.462 20 5 DIBDHN CS[C@H]1CCC[C@@H](NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000230143285 340619105 /nfs/dbraw/zinc/61/91/05/340619105.db2.gz RXUARDRUKXHIDD-YPMHNXCESA-N 0 3 314.838 4.012 20 5 DIBDHN CCc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)s1 ZINC000231884447 340627257 /nfs/dbraw/zinc/62/72/57/340627257.db2.gz NVANYRPECCCSEC-LBPRGKRZSA-N 0 3 304.415 4.378 20 5 DIBDHN Cc1c([C@H](C)N[C@@H]2c3ccccc3C[C@H]2C)cccc1[N+](=O)[O-] ZINC000537978842 340795065 /nfs/dbraw/zinc/79/50/65/340795065.db2.gz IUQUNHOGFSLFEX-UHYGZKCKSA-N 0 3 310.397 4.487 20 5 DIBDHN CC[C@@H](NC[C@H](C)Oc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000539083473 340871520 /nfs/dbraw/zinc/87/15/20/340871520.db2.gz NHCKFJWXVDDJDC-KBXCAEBGSA-N 0 3 314.385 4.103 20 5 DIBDHN C[C@@H](NCCSc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000539275589 340879077 /nfs/dbraw/zinc/87/90/77/340879077.db2.gz UZZNKJSPJIUNLZ-GFCCVEGCSA-N 0 3 320.389 4.177 20 5 DIBDHN C[C@@H](NCc1cc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000540167013 340919775 /nfs/dbraw/zinc/91/97/75/340919775.db2.gz XDIBSYFPLJRXOI-GFCCVEGCSA-N 0 3 316.426 4.386 20 5 DIBDHN C[C@H](Cc1ccsc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000543058903 341029684 /nfs/dbraw/zinc/02/96/84/341029684.db2.gz RTOOUKREBASRGO-CYBMUJFWSA-N 0 3 316.426 4.252 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN(Cc1cccs1)C(C)C ZINC000544606821 341088575 /nfs/dbraw/zinc/08/85/75/341088575.db2.gz WLVIGMLNQJKFOO-UHFFFAOYSA-N 0 3 304.415 4.375 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1c1cccs1 ZINC000544613647 341089184 /nfs/dbraw/zinc/08/91/84/341089184.db2.gz KAPYUUJUCCCFID-OAHLLOKOSA-N 0 3 302.399 4.302 20 5 DIBDHN CC(C)(NCc1cccc2cc[nH]c21)c1ccc([N+](=O)[O-])cc1 ZINC000236698578 341195468 /nfs/dbraw/zinc/19/54/68/341195468.db2.gz LPMKQONRRDUENA-UHFFFAOYSA-N 0 3 309.369 4.101 20 5 DIBDHN Cc1cc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000547286171 341203677 /nfs/dbraw/zinc/20/36/77/341203677.db2.gz QCNLAZHJWYXNCV-UHFFFAOYSA-N 0 3 304.415 4.298 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCCO[C@@H]1CC(C)C ZINC000547831494 341236155 /nfs/dbraw/zinc/23/61/55/341236155.db2.gz LEAAJBLJHPYPLP-BMGDILEWSA-N 0 3 320.433 4.148 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H]2CCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000178687532 341961955 /nfs/dbraw/zinc/96/19/55/341961955.db2.gz AWGIHTDNNBZXFK-PXAZEXFGSA-N 0 3 314.360 4.380 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000297459650 536902065 /nfs/dbraw/zinc/90/20/65/536902065.db2.gz XRUCKNBQRVXUAU-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN CC[C@H](C)[C@H](C)N(Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CC1 ZINC001167356104 1036962868 /nfs/dbraw/zinc/96/28/68/1036962868.db2.gz JKSYBZKBRWYUQV-RYUDHWBXSA-N 0 3 324.396 4.142 20 5 DIBDHN CC[C@@H]1CC[C@@H](C)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000537853144 1037354603 /nfs/dbraw/zinc/35/46/03/1037354603.db2.gz WFYGAMCVUOUOOJ-IUODEOHRSA-N 0 3 315.373 4.013 20 5 DIBDHN CCC[C@H](NCc1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000126116256 1037379604 /nfs/dbraw/zinc/37/96/04/1037379604.db2.gz JKNDUDYTACJFFY-SFHVURJKSA-N 0 3 314.385 4.234 20 5 DIBDHN CC(C)[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000276305870 1037691311 /nfs/dbraw/zinc/69/13/11/1037691311.db2.gz KYJKJRZTXDOCNN-QGZVFWFLSA-N 0 3 302.349 4.221 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc3cccnc3c2)cc1[N+](=O)[O-] ZINC000610518236 1037810387 /nfs/dbraw/zinc/81/03/87/1037810387.db2.gz XABJGQVIVULBKY-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCC(F)(F)C3)o2)cc1 ZINC000610787755 1038306612 /nfs/dbraw/zinc/30/66/12/1038306612.db2.gz JXIVMZDUTQSQTC-LBPRGKRZSA-N 0 3 322.311 4.132 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CCC(F)(F)C2)o1 ZINC000610787844 1038308518 /nfs/dbraw/zinc/30/85/18/1038308518.db2.gz YUJBACICBBKSSJ-NSHDSACASA-N 0 3 322.311 4.132 20 5 DIBDHN CCCCC[C@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859422 1038381114 /nfs/dbraw/zinc/38/11/14/1038381114.db2.gz BACSAKFLAAEEII-ZDUSSCGKSA-N 0 3 317.389 4.281 20 5 DIBDHN CC(C)C[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001167548846 1038585151 /nfs/dbraw/zinc/58/51/51/1038585151.db2.gz IZAWVYCHLNFLMA-OAHLLOKOSA-N 0 3 320.433 4.250 20 5 DIBDHN CC[C@@H](N[C@H]1CCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000178675615 1038957030 /nfs/dbraw/zinc/95/70/30/1038957030.db2.gz DGWNSMQMAQVEAY-MSOLQXFVSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1cc([C@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000035253041 1039075901 /nfs/dbraw/zinc/07/59/01/1039075901.db2.gz SAULLVQSDQCBFY-LBPRGKRZSA-N 0 3 304.415 4.432 20 5 DIBDHN Cc1cc([C@@H](NCc2cccc([N+](=O)[O-])c2)C2CC2)ccc1F ZINC000535369349 1039195288 /nfs/dbraw/zinc/19/52/88/1039195288.db2.gz SIPXPPHBWSSIEN-SFHVURJKSA-N 0 3 314.360 4.283 20 5 DIBDHN CCN(Cc1c[nH]c2ccccc12)Cc1cccc([N+](=O)[O-])c1 ZINC000442881059 1039242601 /nfs/dbraw/zinc/24/26/01/1039242601.db2.gz LQNJFJLKZCAETP-UHFFFAOYSA-N 0 3 309.369 4.098 20 5 DIBDHN CCc1cnccc1[C@@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540314702 1039476364 /nfs/dbraw/zinc/47/63/64/1039476364.db2.gz VCCLSYYWVNIWCZ-ZIAGYGMSSA-N 0 3 313.401 4.272 20 5 DIBDHN CCc1cnccc1[C@@H](C)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540314701 1039477277 /nfs/dbraw/zinc/47/72/77/1039477277.db2.gz VCCLSYYWVNIWCZ-UONOGXRCSA-N 0 3 313.401 4.272 20 5 DIBDHN CC[C@H](N[C@H]1CCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000090068584 1039589570 /nfs/dbraw/zinc/58/95/70/1039589570.db2.gz DGWNSMQMAQVEAY-ROUUACIJSA-N 0 3 314.360 4.462 20 5 DIBDHN COc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000414132890 1040904463 /nfs/dbraw/zinc/90/44/63/1040904463.db2.gz MXTSJVGJXJAIBO-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000053148120 1041443193 /nfs/dbraw/zinc/44/31/93/1041443193.db2.gz CSLHWFNJWKGLSE-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN CC[C@@H](c1ccncc1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290496684 1041512590 /nfs/dbraw/zinc/51/25/90/1041512590.db2.gz OVZPKGKQSCMJGH-JKNJVXJCSA-N 0 3 311.385 4.086 20 5 DIBDHN CSCCCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480919 1041528926 /nfs/dbraw/zinc/52/89/26/1041528926.db2.gz JRYPPMBBEQYXNB-UHFFFAOYSA-N 0 3 323.245 4.134 20 5 DIBDHN CCOc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000391094408 1042181767 /nfs/dbraw/zinc/18/17/67/1042181767.db2.gz QXHIPEBBRIQWBX-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1c([C@H](C)NCc2cccc3cccnc32)cccc1[N+](=O)[O-] ZINC000120516578 1042467024 /nfs/dbraw/zinc/46/70/24/1042467024.db2.gz FPDLEMLFZWTCKY-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN Cc1ccc(CN(C)C/C=C\c2ccccc2[N+](=O)[O-])s1 ZINC000513418514 1042539578 /nfs/dbraw/zinc/53/95/78/1042539578.db2.gz BPCPLICZXKXQNI-ALCCZGGFSA-N 0 3 302.399 4.110 20 5 DIBDHN CCC[C@@H](NCc1cc(C)nc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000421866506 1042659540 /nfs/dbraw/zinc/65/95/40/1042659540.db2.gz BBVXKOUTBACMEY-GOSISDBHSA-N 0 3 313.401 4.238 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1CCCc2sccc21 ZINC000183784360 1043170269 /nfs/dbraw/zinc/17/02/69/1043170269.db2.gz DJJRREZBUVMNQC-HNNXBMFYSA-N 0 3 302.399 4.132 20 5 DIBDHN CC(C)OC1CCC(N[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872051486 1043436177 /nfs/dbraw/zinc/43/61/77/1043436177.db2.gz JDANCJJVYNBBAF-IYXRBSQSSA-N 0 3 324.396 4.121 20 5 DIBDHN Cc1ccccc1[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000283227348 1043464029 /nfs/dbraw/zinc/46/40/29/1043464029.db2.gz TYWWBPRTRBGEAS-GOSISDBHSA-N 0 3 314.360 4.283 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCc1ccc(C(F)F)cc1 ZINC000873107024 1043516693 /nfs/dbraw/zinc/51/66/93/1043516693.db2.gz MAZULWRTRURAKV-UHFFFAOYSA-N 0 3 320.339 4.439 20 5 DIBDHN CCCNc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000873115276 1043517156 /nfs/dbraw/zinc/51/71/56/1043517156.db2.gz KJTJGJFGPJHGOX-UHFFFAOYSA-N 0 3 313.401 4.015 20 5 DIBDHN Cc1c(CNCc2ccc3ccccc3c2)cccc1[N+](=O)[O-] ZINC000323474278 1043842385 /nfs/dbraw/zinc/84/23/85/1043842385.db2.gz KKNWUMKTLPRSSD-UHFFFAOYSA-N 0 3 306.365 4.346 20 5 DIBDHN Cc1c(CN[C@@H]2CCCc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000358331463 1044054326 /nfs/dbraw/zinc/05/43/26/1044054326.db2.gz APHLNCWZJQWDSZ-QGZVFWFLSA-N 0 3 314.360 4.210 20 5 DIBDHN CSc1ccc([C@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000035256529 1044319617 /nfs/dbraw/zinc/31/96/17/1044319617.db2.gz HOTPSZFEFZHNRI-LBPRGKRZSA-N 0 3 302.399 4.168 20 5 DIBDHN CSc1ccc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000035256530 1044320514 /nfs/dbraw/zinc/32/05/14/1044320514.db2.gz HOTPSZFEFZHNRI-GFCCVEGCSA-N 0 3 302.399 4.168 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccc(Cl)cc1 ZINC000567291267 1044556526 /nfs/dbraw/zinc/55/65/26/1044556526.db2.gz WDDAZUNVJWRLTL-HNNXBMFYSA-N 0 3 302.761 4.025 20 5 DIBDHN C[C@@H](c1ccccc1Cl)N(C)CCc1ccc([N+](=O)[O-])cc1 ZINC000523702106 1044676904 /nfs/dbraw/zinc/67/69/04/1044676904.db2.gz CBFMPPNBKZOLAK-ZDUSSCGKSA-N 0 3 318.804 4.484 20 5 DIBDHN CCOc1ccc([C@H](C)N[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000089552859 1044742704 /nfs/dbraw/zinc/74/27/04/1044742704.db2.gz NYZKCMXDYBMNNI-KBPBESRZSA-N 0 3 314.385 4.405 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN[C@H]1CCC[C@@H]1c1ccccc1 ZINC000445995326 1044871352 /nfs/dbraw/zinc/87/13/52/1044871352.db2.gz SMEDOOPBFAFRGV-PBHICJAKSA-N 0 3 314.360 4.160 20 5 DIBDHN CCOc1ccc([C@@H](C)NCc2ccc(C)s2)cc1[N+](=O)[O-] ZINC000152982968 1045050928 /nfs/dbraw/zinc/05/09/28/1045050928.db2.gz WXZYPXQPFPIHET-GFCCVEGCSA-N 0 3 320.414 4.214 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccc(C2CC2)cc1 ZINC000579024852 1045290244 /nfs/dbraw/zinc/29/02/44/1045290244.db2.gz TWYXNDCBVSGXQR-GOSISDBHSA-N 0 3 308.381 4.249 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H](CC2CC2)c2ccccc2)cc1F ZINC000801531684 1045734132 /nfs/dbraw/zinc/73/41/32/1045734132.db2.gz SOYSLDANIAOXCP-QGZVFWFLSA-N 0 3 314.360 4.365 20 5 DIBDHN C[C@@H](CN[C@H](C)c1ccncc1Cl)c1ccccc1[N+](=O)[O-] ZINC000903246212 1046207014 /nfs/dbraw/zinc/20/70/14/1046207014.db2.gz SGNHPNMZQSJWAL-NWDGAFQWSA-N 0 3 319.792 4.098 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H](c1ccncc1)C1CC1)CCC2 ZINC000903427808 1046277243 /nfs/dbraw/zinc/27/72/43/1046277243.db2.gz KFHHBCASQSMKEM-OALUTQOASA-N 0 3 323.396 4.108 20 5 DIBDHN Cc1ccc([C@H]2CCN(Cc3cc(F)ccc3[N+](=O)[O-])C2)cc1 ZINC000784479009 1046691910 /nfs/dbraw/zinc/69/19/10/1046691910.db2.gz ZQPLZKCBXOUFEU-HNNXBMFYSA-N 0 3 314.360 4.032 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(CN[C@@H]2C=CCC2)o1 ZINC001203056398 1046843399 /nfs/dbraw/zinc/84/33/99/1046843399.db2.gz XXURDQSLKUZYEK-GFCCVEGCSA-N 0 3 318.760 4.316 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1c2ccccc2C[C@H]1C ZINC000536873430 1047116841 /nfs/dbraw/zinc/11/68/41/1047116841.db2.gz ZYOUNLPHKSXSAU-TYILLQQXSA-N 0 3 310.397 4.487 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCc2cc(F)ccc21 ZINC000163503991 1047234910 /nfs/dbraw/zinc/23/49/10/1047234910.db2.gz RTOVSCPIHMZEHH-SGTLLEGYSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCc2cc(F)ccc21 ZINC000163503698 1047235038 /nfs/dbraw/zinc/23/50/38/1047235038.db2.gz RTOVSCPIHMZEHH-KZULUSFZSA-N 0 3 314.360 4.380 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2CN1CCOC2(CC2)C1 ZINC001141728567 1047281179 /nfs/dbraw/zinc/28/11/79/1047281179.db2.gz XIPZXYSICDMXKV-UHFFFAOYSA-N 0 3 303.405 4.358 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN(CC[C@@H]1CCCC1(F)F)C1CC1 ZINC001168316541 1047425788 /nfs/dbraw/zinc/42/57/88/1047425788.db2.gz CMHDDQGOHQMSAA-AWEZNQCLSA-N 0 3 324.371 4.385 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@@H]1CCc2ccc(F)cc21 ZINC000537980248 1047649970 /nfs/dbraw/zinc/64/99/70/1047649970.db2.gz ORUUZGXBNHEBGD-KZULUSFZSA-N 0 3 314.360 4.380 20 5 DIBDHN CC(C)(C)C(=N)Nc1cc(Cl)nc2ccc([N+](=O)[O-])cc21 ZINC001155180215 1047670954 /nfs/dbraw/zinc/67/09/54/1047670954.db2.gz MFOYBWBDRJVGSB-UHFFFAOYSA-N 0 3 306.753 4.232 20 5 DIBDHN COc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)c(C)c1 ZINC000539064766 1047730739 /nfs/dbraw/zinc/73/07/39/1047730739.db2.gz DLVWRSSVUUYBCI-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000539094449 1047735632 /nfs/dbraw/zinc/73/56/32/1047735632.db2.gz WIKNRZBHEAQQAQ-QGZVFWFLSA-N 0 3 316.788 4.415 20 5 DIBDHN CC(C)P(CCNc1nccc(Cl)c1[N+](=O)[O-])C(C)C ZINC001162358644 1048267386 /nfs/dbraw/zinc/26/73/86/1048267386.db2.gz UMXMGNQGBLXTMS-UHFFFAOYSA-N 0 3 317.757 4.354 20 5 DIBDHN CC(C)P(CCNc1cc(Cl)ncc1[N+](=O)[O-])C(C)C ZINC001162358691 1048267916 /nfs/dbraw/zinc/26/79/16/1048267916.db2.gz QJUDYIAPFMCYIQ-UHFFFAOYSA-N 0 3 317.757 4.354 20 5 DIBDHN CCC[C@@H](C)[C@H]1CCCN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001192173986 1049055775 /nfs/dbraw/zinc/05/57/75/1049055775.db2.gz NPNBACQFZOTYFL-IUODEOHRSA-N 0 3 324.396 4.143 20 5 DIBDHN CC[C@H](C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001179105668 1049131975 /nfs/dbraw/zinc/13/19/75/1049131975.db2.gz KXHCLPWMBQGOCI-LBPRGKRZSA-N 0 3 319.430 4.244 20 5 DIBDHN CCOc1cccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173364193 1049139169 /nfs/dbraw/zinc/13/91/69/1049139169.db2.gz RHTZSIOSHMDZEP-UONOGXRCSA-N 0 3 314.385 4.405 20 5 DIBDHN CC[C@@H](NCc1ccc2cc[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC001192814684 1049139911 /nfs/dbraw/zinc/13/99/11/1049139911.db2.gz XBFFWZVQRYFVAA-QGZVFWFLSA-N 0 3 309.369 4.317 20 5 DIBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000485713815 1049324476 /nfs/dbraw/zinc/32/44/76/1049324476.db2.gz AGCSUOARGLWPBH-NSHDSACASA-N 0 3 313.382 4.055 20 5 DIBDHN C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCC[C@H](C)C1 ZINC001195179673 1049483609 /nfs/dbraw/zinc/48/36/09/1049483609.db2.gz OHCPSMLATJZGAX-AVGNSLFASA-N 0 3 317.389 4.040 20 5 DIBDHN CC1(C)CCC[C@@H]1[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195429020 1049531867 /nfs/dbraw/zinc/53/18/67/1049531867.db2.gz ZDAJUEJCEWKXAD-CZUORRHYSA-N 0 3 320.408 4.382 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC2(CC2(F)F)CC1 ZINC000593072474 1050382211 /nfs/dbraw/zinc/38/22/11/1050382211.db2.gz HQRKNUOIYNNMGZ-GFCCVEGCSA-N 0 3 310.344 4.085 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H]1CCCc2ccccc21 ZINC000594492522 1050516589 /nfs/dbraw/zinc/51/65/89/1050516589.db2.gz NLPKPHKXGJESLJ-ZWKOTPCHSA-N 0 3 308.381 4.249 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000788498285 1050692571 /nfs/dbraw/zinc/69/25/71/1050692571.db2.gz MWBVRBNHTADUOC-MNOVXSKESA-N 0 3 319.792 4.242 20 5 DIBDHN Cc1c(CNC(C)(C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000103482796 1051151404 /nfs/dbraw/zinc/15/14/04/1051151404.db2.gz FSECJIQONNIWMA-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN Cc1ccc(CNC2(c3ccccc3C)CCC2)cc1[N+](=O)[O-] ZINC001171700118 1051197165 /nfs/dbraw/zinc/19/71/65/1051197165.db2.gz HTWIKWHREQMXDW-UHFFFAOYSA-N 0 3 310.397 4.381 20 5 DIBDHN CCC[C@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC001168775174 1051237697 /nfs/dbraw/zinc/23/76/97/1051237697.db2.gz NJJOFJQXZIBGEG-INIZCTEOSA-N 0 3 314.385 4.234 20 5 DIBDHN C[C@H](N[C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1c(Cl)cccc1Cl ZINC001168978357 1051476014 /nfs/dbraw/zinc/47/60/14/1051476014.db2.gz RHJBAVQIVYUDDS-AXFHLTTASA-N 0 3 317.216 4.089 20 5 DIBDHN CCCC[C@H]1CCC[C@@H]1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC001168980094 1051477480 /nfs/dbraw/zinc/47/74/80/1051477480.db2.gz IDRKYFFLSBCZPY-ZBEGNZNMSA-N 0 3 312.360 4.322 20 5 DIBDHN CCCC[C@@H]1CCC[C@@H]1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC001168980090 1051477851 /nfs/dbraw/zinc/47/78/51/1051477851.db2.gz IDRKYFFLSBCZPY-BZNIZROVSA-N 0 3 312.360 4.322 20 5 DIBDHN C[C@@H](N[C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1c(Cl)cccc1Cl ZINC001168988367 1051491572 /nfs/dbraw/zinc/49/15/72/1051491572.db2.gz RHJBAVQIVYUDDS-MXWKQRLJSA-N 0 3 317.216 4.089 20 5 DIBDHN Cc1ccc2c(c1)[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)CC2 ZINC000761520241 1051587450 /nfs/dbraw/zinc/58/74/50/1051587450.db2.gz NDDFLYPWVRQWPO-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN C[C@H](Cc1ccc([N+](=O)[O-])cc1)NCc1c(F)cccc1Cl ZINC001173213912 1051649903 /nfs/dbraw/zinc/64/99/03/1051649903.db2.gz LXNTXHGJWHYLFN-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN Cc1c(CN(C)Cc2cccc3[nH]ccc32)cccc1[N+](=O)[O-] ZINC000494106913 1051691314 /nfs/dbraw/zinc/69/13/14/1051691314.db2.gz LHLHHHKOUDNJES-UHFFFAOYSA-N 0 3 309.369 4.017 20 5 DIBDHN C[C@@H](NCc1ccc(OC(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000193234395 1052260974 /nfs/dbraw/zinc/26/09/74/1052260974.db2.gz JCVSJNILFRAPHX-LLVKDONJSA-N 0 3 322.311 4.047 20 5 DIBDHN Cc1ccc([C@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000495372915 1052326449 /nfs/dbraw/zinc/32/64/49/1052326449.db2.gz BZZRWPQAPRTBSI-NSHDSACASA-N 0 3 308.765 4.043 20 5 DIBDHN C[C@@H]1CCN(Cc2cc(F)ccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000917053301 1052683723 /nfs/dbraw/zinc/68/37/23/1052683723.db2.gz ZQGBXLLNFLWDNH-SRCQZFHVSA-N 0 3 306.381 4.135 20 5 DIBDHN CC1(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCC1 ZINC000609599620 1052983987 /nfs/dbraw/zinc/98/39/87/1052983987.db2.gz CDJRXUDGYFYHJB-UHFFFAOYSA-N 0 3 317.414 4.141 20 5 DIBDHN CCN(CCc1cccs1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705268 1052988391 /nfs/dbraw/zinc/98/83/91/1052988391.db2.gz NEQRESZWLJWRCZ-UHFFFAOYSA-N 0 3 324.833 4.374 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H]1C1CCCC1 ZINC000609705316 1052988697 /nfs/dbraw/zinc/98/86/97/1052988697.db2.gz UIJMJDXWIUSGCN-HNNXBMFYSA-N 0 3 308.809 4.403 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCc3cc(Cl)ccc32)cc1[N+](=O)[O-] ZINC000237798991 1053028264 /nfs/dbraw/zinc/02/82/64/1053028264.db2.gz IUWNSOPTSMNMLO-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN Cc1ccc(CN[C@H]2CCc3cc(Cl)ccc32)cc1[N+](=O)[O-] ZINC000237804931 1053028536 /nfs/dbraw/zinc/02/85/36/1053028536.db2.gz IUWNSOPTSMNMLO-INIZCTEOSA-N 0 3 316.788 4.334 20 5 DIBDHN CCCC[C@H]1CCC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000617220453 1053117228 /nfs/dbraw/zinc/11/72/28/1053117228.db2.gz BEVIRLWPHINCMU-JSGCOSHPSA-N 0 3 317.389 4.185 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc3cnccc3c2)cc1[N+](=O)[O-] ZINC000618725857 1053353379 /nfs/dbraw/zinc/35/33/79/1053353379.db2.gz WKMOMJQNIBIXHH-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CSc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000037775649 1053564535 /nfs/dbraw/zinc/56/45/35/1053564535.db2.gz YHEMCFPTWVDCBE-LBPRGKRZSA-N 0 3 302.399 4.168 20 5 DIBDHN CC[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC001329112519 1053967548 /nfs/dbraw/zinc/96/75/48/1053967548.db2.gz FVQFPCKQQYOJDQ-IRXDYDNUSA-N 0 3 314.360 4.462 20 5 DIBDHN CC[C@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC001620810084 1056003096 /nfs/dbraw/zinc/00/30/96/1056003096.db2.gz CIIDFZLZHNECPO-KRWDZBQOSA-N 0 3 313.401 4.354 20 5 DIBDHN C[C@H](Cc1cccs1)N(C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001615818218 1056579192 /nfs/dbraw/zinc/57/91/92/1056579192.db2.gz REHIKYUCKULZPI-LLVKDONJSA-N 0 3 324.833 4.373 20 5 DIBDHN O=[N+]([O-])c1cccc(CN(C[C@@H]2CCCCC2(F)F)C2CC2)c1 ZINC001615930513 1056597476 /nfs/dbraw/zinc/59/74/76/1056597476.db2.gz BNAPLNYUJYKXIM-AWEZNQCLSA-N 0 3 324.371 4.385 20 5 DIBDHN CC[C@H](NCc1ccc2c(c1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC001616793818 1056718070 /nfs/dbraw/zinc/71/80/70/1056718070.db2.gz DDQAKSXFZPUYAL-IBGZPJMESA-N 0 3 310.397 4.324 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](C(C)C)C1 ZINC001617272956 1056805114 /nfs/dbraw/zinc/80/51/14/1056805114.db2.gz GSRAASJJDKDKFK-HNNXBMFYSA-N 0 3 320.433 4.250 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2-c1ncc2c(n1)CNCC2 ZINC001241378432 1057030817 /nfs/dbraw/zinc/03/08/17/1057030817.db2.gz FQXVKLLTUXZUQO-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN[C@H]1CCCc2cccnc21 ZINC000922880450 1057073224 /nfs/dbraw/zinc/07/32/24/1057073224.db2.gz CDKMTKWPVIJPQQ-RMHQSFGDSA-N 0 3 323.396 4.060 20 5 DIBDHN Cc1c(CN2CCC(C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC001559576772 1059409559 /nfs/dbraw/zinc/40/95/59/1059409559.db2.gz LEGLDXUADYYMPQ-UHFFFAOYSA-N 0 3 302.418 4.305 20 5 DIBDHN CC(C)(CCN(Cc1ccccc1[N+](=O)[O-])C1CC1)C1CC1 ZINC001559665349 1059496259 /nfs/dbraw/zinc/49/62/59/1059496259.db2.gz JBGRVVDFJKOCDQ-UHFFFAOYSA-N 0 3 302.418 4.386 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@H]2CC2CCC2)c(F)c1 ZINC001560017940 1059828292 /nfs/dbraw/zinc/82/82/92/1059828292.db2.gz ZELXWNMTWVECNV-HNNXBMFYSA-N 0 3 306.381 4.279 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC2(CCSCC2)CC1 ZINC001560047274 1059864602 /nfs/dbraw/zinc/86/46/02/1059864602.db2.gz BIKLHIBAFVJGHM-AWEZNQCLSA-N 0 3 320.458 4.265 20 5 DIBDHN CSCc1cccc(CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC001560444252 1060234900 /nfs/dbraw/zinc/23/49/00/1060234900.db2.gz IFNKOGWOOHMCOH-UHFFFAOYSA-N 0 3 316.426 4.056 20 5 DIBDHN CNc1ccccc1CN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001560682741 1060528068 /nfs/dbraw/zinc/52/80/68/1060528068.db2.gz QESPNMZZQHTVNL-UHFFFAOYSA-N 0 3 313.401 4.047 20 5 DIBDHN C[C@@H]1C[C@H](C)CN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001560715445 1060572241 /nfs/dbraw/zinc/57/22/41/1060572241.db2.gz IKYAFKPDDIMSFZ-PHIMTYICSA-N 0 3 316.323 4.092 20 5 DIBDHN CC[C@H](C)CN(CC)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001473204487 1060970477 /nfs/dbraw/zinc/97/04/77/1060970477.db2.gz SMDMDIOOABQGCK-AWEZNQCLSA-N 0 3 308.422 4.250 20 5 DIBDHN Cc1ccccc1OCCCN[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000538224494 1061181579 /nfs/dbraw/zinc/18/15/79/1061181579.db2.gz DREDPAKKWBUFOM-OAHLLOKOSA-N 0 3 314.385 4.023 20 5 DIBDHN CCC1(CC)CCCN(Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC001473641243 1061311793 /nfs/dbraw/zinc/31/17/93/1061311793.db2.gz JQWPRQPOXKOGQD-UHFFFAOYSA-N 0 3 306.406 4.006 20 5 DIBDHN O=[N+]([O-])c1ccc(CNCCCc2ccsc2)c(Cl)c1 ZINC001462664520 1061325717 /nfs/dbraw/zinc/32/57/17/1061325717.db2.gz IKKACQCAYHCQIR-UHFFFAOYSA-N 0 3 310.806 4.032 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1cc(Cl)ccc1F ZINC001254537307 1062165435 /nfs/dbraw/zinc/16/54/35/1062165435.db2.gz ZLVFXYBOZBWTTO-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN CC(C)(C)[C@@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC001459494399 1062169862 /nfs/dbraw/zinc/16/98/62/1062169862.db2.gz VXWFJQTUJKYUIJ-CQSZACIVSA-N 0 3 308.397 4.382 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)c1cc(F)ccc1F ZINC001254543788 1062169967 /nfs/dbraw/zinc/16/99/67/1062169967.db2.gz HCGQKBMBWUQCJP-NEPJUHHUSA-N 0 3 320.339 4.155 20 5 DIBDHN CCCN(Cc1ccccc1[N+](=O)[O-])[C@H]1C[C@@H](OCC)C1(C)C ZINC001459520825 1062180649 /nfs/dbraw/zinc/18/06/49/1062180649.db2.gz ANTCZQLHPWANDT-DLBZAZTESA-N 0 3 320.433 4.010 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC001459823561 1062428774 /nfs/dbraw/zinc/42/87/74/1062428774.db2.gz ACXGDKWSUPGHSX-LBPRGKRZSA-N 0 3 304.415 4.432 20 5 DIBDHN O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3ccccc3F)C2)cc1 ZINC001460126771 1062649118 /nfs/dbraw/zinc/64/91/18/1062649118.db2.gz FPYVPXHXGDXEBJ-HNNXBMFYSA-N 0 3 314.360 4.114 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN1CCC[C@H]1CC1CCCC1 ZINC001460317914 1062777648 /nfs/dbraw/zinc/77/76/48/1062777648.db2.gz UJNSXAQKKAYSQW-AWEZNQCLSA-N 0 3 306.381 4.279 20 5 DIBDHN C[C@]12CN(Cc3cc([N+](=O)[O-])ccc3Cl)C[C@H]1[C@H]1CC[C@@H]2C1 ZINC001308119939 1065769269 /nfs/dbraw/zinc/76/92/69/1065769269.db2.gz VSTUYTKQDXAPJW-MAQMMGONSA-N 0 3 320.820 4.116 20 5 DIBDHN Cc1ccc([C@@H](C)CN2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC001308629916 1066126900 /nfs/dbraw/zinc/12/69/00/1066126900.db2.gz NSEJDLWOUFHQRD-HNNXBMFYSA-N 0 3 310.397 4.065 20 5 DIBDHN C[C@H]1CCCCCN1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001308700885 1066187355 /nfs/dbraw/zinc/18/73/55/1066187355.db2.gz DHESGBXEBYJNDS-NSHDSACASA-N 0 3 316.323 4.378 20 5 DIBDHN CCOc1ccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000078995811 185142988 /nfs/dbraw/zinc/14/29/88/185142988.db2.gz XXRGGTYLRNRFAR-UONOGXRCSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@H](N[C@H]1CCCc2sccc21)c1ccc([N+](=O)[O-])cc1 ZINC000061359971 184169032 /nfs/dbraw/zinc/16/90/32/184169032.db2.gz XKBFJSKLYFGYKP-NHYWBVRUSA-N 0 3 302.399 4.385 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CNCCc2ccccc2)o1 ZINC000409647495 332043512 /nfs/dbraw/zinc/04/35/12/332043512.db2.gz JNUJHGRGYUOTRH-UHFFFAOYSA-N 0 3 322.364 4.187 20 5 DIBDHN CCOc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000159391105 332082629 /nfs/dbraw/zinc/08/26/29/332082629.db2.gz HQWXIEQIRVPFJM-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN CCOc1cccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000159390945 332082635 /nfs/dbraw/zinc/08/26/35/332082635.db2.gz IRFJGNQJTFKTNB-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN CCOc1cccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000159390825 332082684 /nfs/dbraw/zinc/08/26/84/332082684.db2.gz IRFJGNQJTFKTNB-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN CC[C@@H](NCc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000053148084 332961847 /nfs/dbraw/zinc/96/18/47/332961847.db2.gz KKWZGBIBUKOXDW-MRXNPFEDSA-N 0 3 304.777 4.489 20 5 DIBDHN CCC[C@H](NCCc1csc(C)n1)c1cccc([N+](=O)[O-])c1 ZINC000319043444 333249288 /nfs/dbraw/zinc/24/92/88/333249288.db2.gz AWUKUXFKGXLCOK-INIZCTEOSA-N 0 3 319.430 4.033 20 5 DIBDHN Cc1ccc([C@@H](NCc2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000391110842 333420307 /nfs/dbraw/zinc/42/03/07/333420307.db2.gz UHASNLNPQWMSOL-LJQANCHMSA-N 0 3 310.397 4.453 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000438472380 334117470 /nfs/dbraw/zinc/11/74/70/334117470.db2.gz XSNVHMYHNPEOIT-IYNGYCSASA-N 0 3 316.323 4.175 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000438472383 334117481 /nfs/dbraw/zinc/11/74/81/334117481.db2.gz XSNVHMYHNPEOIT-SCXUMTSISA-N 0 3 316.323 4.175 20 5 DIBDHN C[C@@H](N[C@@H](C)[C@@H]1C[C@H]1c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000417311868 334705027 /nfs/dbraw/zinc/70/50/27/334705027.db2.gz QMFBLDFUASQTBS-PAPYEOQZSA-N 0 3 316.426 4.499 20 5 DIBDHN CC[C@@H](NCc1cc(C)cc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000181616364 337183458 /nfs/dbraw/zinc/18/34/58/337183458.db2.gz AVDIWRXDGACEDB-GOSISDBHSA-N 0 3 314.385 4.153 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H](c1cccs1)C1CC1 ZINC000571820820 337578261 /nfs/dbraw/zinc/57/82/61/337578261.db2.gz WTUZMRCEVVXYRK-WMLDXEAASA-N 0 3 314.410 4.385 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H](C)Oc1ccccc1 ZINC000536873068 337758345 /nfs/dbraw/zinc/75/83/45/337758345.db2.gz WBEYGLCQINPVJG-CABCVRRESA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)ccc1F ZINC000119405126 337859356 /nfs/dbraw/zinc/85/93/56/337859356.db2.gz WYIZCDFIRUUVOQ-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN CC(C)(NC/C=C/c1ccccc1[N+](=O)[O-])c1cccs1 ZINC000537306417 337930027 /nfs/dbraw/zinc/93/00/27/337930027.db2.gz HANFDXCYDLWSJV-VMPITWQZSA-N 0 3 302.399 4.194 20 5 DIBDHN CC(C)(NC[C@@H]1C[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000429272907 338075653 /nfs/dbraw/zinc/07/56/53/338075653.db2.gz LBTTVODISVGDFN-HOTGVXAUSA-N 0 3 310.397 4.223 20 5 DIBDHN Cc1cscc1CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433059015 338179159 /nfs/dbraw/zinc/17/91/59/338179159.db2.gz BZZLHXLZJDZXDL-MRXNPFEDSA-N 0 3 316.426 4.477 20 5 DIBDHN Cc1ccccc1CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433125869 338182524 /nfs/dbraw/zinc/18/25/24/338182524.db2.gz MESJIOWRQRJAEQ-GOSISDBHSA-N 0 3 310.397 4.415 20 5 DIBDHN CC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000152800889 338212114 /nfs/dbraw/zinc/21/21/14/338212114.db2.gz MPGHTIQUNCECKW-FZKQIMNGSA-N 0 3 314.385 4.405 20 5 DIBDHN CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000152800794 338212174 /nfs/dbraw/zinc/21/21/74/338212174.db2.gz MPGHTIQUNCECKW-ACJLOTCBSA-N 0 3 314.385 4.405 20 5 DIBDHN CCc1ccccc1CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447545094 338555954 /nfs/dbraw/zinc/55/59/54/338555954.db2.gz XAPUQHYZZSODHS-LJQANCHMSA-N 0 3 310.397 4.324 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000449348873 338616201 /nfs/dbraw/zinc/61/62/01/338616201.db2.gz HOIHOWGTDDIIFG-KRWDZBQOSA-N 0 3 314.360 4.210 20 5 DIBDHN Cc1csc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000453314042 338823125 /nfs/dbraw/zinc/82/31/25/338823125.db2.gz ICNOUJNGSLVHKG-MRXNPFEDSA-N 0 3 302.399 4.132 20 5 DIBDHN Cc1ccc([C@@H](C)NCCSc2ccccc2)cc1[N+](=O)[O-] ZINC000195678290 338913925 /nfs/dbraw/zinc/91/39/25/338913925.db2.gz KJOSAOHCUNZJTL-CQSZACIVSA-N 0 3 316.426 4.346 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CNCc1ccc(C(F)F)cc1 ZINC000462639659 339083104 /nfs/dbraw/zinc/08/31/04/339083104.db2.gz ICGOCADRGYLCCX-HYXAFXHYSA-N 0 3 318.323 4.335 20 5 DIBDHN O=[N+]([O-])c1ccc(CCCCNCc2ccccc2Cl)cc1 ZINC000462762462 339087422 /nfs/dbraw/zinc/08/74/22/339087422.db2.gz KAWSRYXNUMFCQM-UHFFFAOYSA-N 0 3 318.804 4.361 20 5 DIBDHN CN(Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463020238 339100793 /nfs/dbraw/zinc/10/07/93/339100793.db2.gz BZJOYWUUPAZHOL-KGLIPLIRSA-N 0 3 316.323 4.148 20 5 DIBDHN CN(Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000463025101 339101091 /nfs/dbraw/zinc/10/10/91/339101091.db2.gz ROSAOIZGYJTJMM-KGLIPLIRSA-N 0 3 316.323 4.148 20 5 DIBDHN CCCN(CCc1cccs1)Cc1csc([N+](=O)[O-])c1 ZINC000464581340 339145855 /nfs/dbraw/zinc/14/58/55/339145855.db2.gz GEWCBWYRJZNUOL-UHFFFAOYSA-N 0 3 310.444 4.173 20 5 DIBDHN C[C@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000464849775 339157727 /nfs/dbraw/zinc/15/77/27/339157727.db2.gz IQYLYRVVVDPGQN-WMLDXEAASA-N 0 3 314.385 4.204 20 5 DIBDHN C[C@@H](NC[C@@H]1CCC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000467209573 339228382 /nfs/dbraw/zinc/22/83/82/339228382.db2.gz XPCFSGZUNYIVHL-PBHICJAKSA-N 0 3 318.417 4.127 20 5 DIBDHN C[C@@H](N[C@@H](C)Cc1ccccc1F)c1ccccc1[N+](=O)[O-] ZINC000467835112 339247270 /nfs/dbraw/zinc/24/72/70/339247270.db2.gz YMPDYERXTWGUMW-QWHCGFSZSA-N 0 3 302.349 4.016 20 5 DIBDHN C[C@@H](CCC(F)(F)F)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000468040811 339252227 /nfs/dbraw/zinc/25/22/27/339252227.db2.gz SDYZFFBXAMPLMD-QMMMGPOBSA-N 0 3 310.703 4.069 20 5 DIBDHN CCS[C@@H]1CCCCN([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468229971 339256787 /nfs/dbraw/zinc/25/67/87/339256787.db2.gz JKFYTNXDIMGOAI-ZIAGYGMSSA-N 0 3 308.447 4.263 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H]1c1ccc[nH]1 ZINC000470173320 339312664 /nfs/dbraw/zinc/31/26/64/339312664.db2.gz AQSCETHXYDUSFA-DEQJRXDXSA-N 0 3 311.385 4.163 20 5 DIBDHN Cc1ccc(C)c2c1CCC[C@@H]2NCc1ccccc1[N+](=O)[O-] ZINC000471598395 339348823 /nfs/dbraw/zinc/34/88/23/339348823.db2.gz WPHZCOGYFWUBAE-KRWDZBQOSA-N 0 3 310.397 4.379 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CCCC4(CC4)C3)o2)cc1 ZINC000473060347 339380843 /nfs/dbraw/zinc/38/08/43/339380843.db2.gz VDELFQFVQORHNZ-UHFFFAOYSA-N 0 3 312.369 4.231 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CCCO[C@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000480724529 339584748 /nfs/dbraw/zinc/58/47/48/339584748.db2.gz VSXSDDQQIDONKP-LESCRADOSA-N 0 3 320.433 4.148 20 5 DIBDHN Cc1ccccc1O[C@@H](C)CN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000483660627 339671131 /nfs/dbraw/zinc/67/11/31/339671131.db2.gz MOMLUUZURAMZHK-LSDHHAIUSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1cccc(O[C@@H](C)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000483715592 339672454 /nfs/dbraw/zinc/67/24/54/339672454.db2.gz QTRVIYZRLKSSNY-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN C[C@H](N[C@H]1CS[C@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000488442127 339782493 /nfs/dbraw/zinc/78/24/93/339782493.db2.gz MKKVRROJAXHFKK-ZOWXZIJZSA-N 0 3 308.447 4.166 20 5 DIBDHN CCc1ccc([C@H](C)NCCc2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000495427237 339984249 /nfs/dbraw/zinc/98/42/49/339984249.db2.gz QKJQLSNPEJCJHN-NSHDSACASA-N 0 3 322.792 4.297 20 5 DIBDHN C[C@@]1(c2ccccc2)CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000500240361 340053890 /nfs/dbraw/zinc/05/38/90/340053890.db2.gz MXTOFNXEWYWUET-LJQANCHMSA-N 0 3 310.397 4.149 20 5 DIBDHN CCSCCCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000500393343 340056431 /nfs/dbraw/zinc/05/64/31/340056431.db2.gz AZZNOMMRCCVZCC-UHFFFAOYSA-N 0 3 320.414 4.088 20 5 DIBDHN CC[C@H]1C[C@]1(NCc1ccc([N+](=O)[O-])cc1)c1cccc(C)c1 ZINC000500505759 340060999 /nfs/dbraw/zinc/06/09/99/340060999.db2.gz ZHAXEAVAFCROCF-QFBILLFUSA-N 0 3 310.397 4.318 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](c2ccccc2F)C1 ZINC000503655326 340133105 /nfs/dbraw/zinc/13/31/05/340133105.db2.gz RFGIRPXXEKXIBO-HIFRSBDPSA-N 0 3 314.360 4.284 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]1c1ccccc1 ZINC000506267277 340190514 /nfs/dbraw/zinc/19/05/14/340190514.db2.gz GXRDUWLWYBJCDT-PMQIGOLDSA-N 0 3 308.381 4.445 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1cccc2[nH]ccc21 ZINC000506732241 340200378 /nfs/dbraw/zinc/20/03/78/340200378.db2.gz VGXNBZKGPRCYFJ-CYBMUJFWSA-N 0 3 309.369 4.269 20 5 DIBDHN CCN(Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC(C)C ZINC000507111179 340207738 /nfs/dbraw/zinc/20/77/38/340207738.db2.gz NXJCTPAMQQCPBH-UHFFFAOYSA-N 0 3 319.430 4.196 20 5 DIBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]ccc21 ZINC000507171258 340210928 /nfs/dbraw/zinc/21/09/28/340210928.db2.gz UGWBAYVDSBJGFE-UHFFFAOYSA-N 0 3 323.396 4.487 20 5 DIBDHN Cc1ccccc1[C@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000507907773 340235618 /nfs/dbraw/zinc/23/56/18/340235618.db2.gz WVDMWKWQEMJFGC-AWEZNQCLSA-N 0 3 314.360 4.032 20 5 DIBDHN CCN(CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000513194038 340396417 /nfs/dbraw/zinc/39/64/17/340396417.db2.gz LCDWYHUDADCLHC-INIZCTEOSA-N 0 3 319.430 4.151 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCc2ccc(F)cc21 ZINC000537980249 340795141 /nfs/dbraw/zinc/79/51/41/340795141.db2.gz ORUUZGXBNHEBGD-SGTLLEGYSA-N 0 3 314.360 4.380 20 5 DIBDHN CC(C)(NC/C=C\c1ccccc1[N+](=O)[O-])c1cccc(F)c1 ZINC000538399503 340821215 /nfs/dbraw/zinc/82/12/15/340821215.db2.gz HVMWQMLGGMMLQR-VURMDHGXSA-N 0 3 314.360 4.272 20 5 DIBDHN C[C@@H](Cc1ccsc1)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000543058905 341029665 /nfs/dbraw/zinc/02/96/65/341029665.db2.gz RTOOUKREBASRGO-ZDUSSCGKSA-N 0 3 316.426 4.252 20 5 DIBDHN COc1cc(CN[C@H](C)c2c(C)cccc2C)ccc1[N+](=O)[O-] ZINC000544895389 341097852 /nfs/dbraw/zinc/09/78/52/341097852.db2.gz AWIXIWGKPUXXBP-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN CC(C)(NC/C=C/c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000545163809 341110813 /nfs/dbraw/zinc/11/08/13/341110813.db2.gz UDMRRFPEQLZCCC-ONEGZZNKSA-N 0 3 314.360 4.272 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC1(Cc2ccccc2)CC1 ZINC000547830695 341236118 /nfs/dbraw/zinc/23/61/18/341236118.db2.gz VPJBSBQQQLZVOJ-HNNXBMFYSA-N 0 3 310.397 4.329 20 5 DIBDHN CCC[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000089513344 341405129 /nfs/dbraw/zinc/40/51/29/341405129.db2.gz AEWQKWVIFUDRES-GOSISDBHSA-N 0 3 314.385 4.234 20 5 DIBDHN CC[C@H](N[C@@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000178089082 341944116 /nfs/dbraw/zinc/94/41/16/341944116.db2.gz JYYDXLBHVPJOEP-ZWKOTPCHSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1c([C@@H](C)N[C@@H]2CCc3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000178088310 341944147 /nfs/dbraw/zinc/94/41/47/341944147.db2.gz AFRLAJQPUKXCEV-SJKOYZFVSA-N 0 3 314.360 4.380 20 5 DIBDHN C[C@@H](N[C@@H]1CCc2c1cccc2F)c1ccc([N+](=O)[O-])cc1 ZINC000267415619 525649566 /nfs/dbraw/zinc/64/95/66/525649566.db2.gz JCLNFXWXXFQUAA-PIGZYNQJSA-N 0 3 300.333 4.072 20 5 DIBDHN CC[C@@H](N[C@H](C)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000119648792 535808593 /nfs/dbraw/zinc/80/85/93/535808593.db2.gz CAFZSWVLEJLNOE-FZKQIMNGSA-N 0 3 314.385 4.405 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000273115074 536903109 /nfs/dbraw/zinc/90/31/09/536903109.db2.gz XDVNXAOMOJGOBS-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN CCS[C@@H]1CCCCN(Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC001167363974 1036985697 /nfs/dbraw/zinc/98/56/97/1036985697.db2.gz QIAUAKVZWGASOQ-OAHLLOKOSA-N 0 3 308.447 4.011 20 5 DIBDHN CC(C)(NCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000119372837 1037689859 /nfs/dbraw/zinc/68/98/59/1037689859.db2.gz GJZKXBYTYADSFA-UHFFFAOYSA-N 0 3 304.777 4.273 20 5 DIBDHN CC[C@@H](NCc1ccc(C)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000610517529 1037807820 /nfs/dbraw/zinc/80/78/20/1037807820.db2.gz HSTDHUGQYDOATO-QGZVFWFLSA-N 0 3 302.349 4.283 20 5 DIBDHN CC[C@H](N[C@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000178089109 1037813532 /nfs/dbraw/zinc/81/35/32/1037813532.db2.gz JYYDXLBHVPJOEP-ROUUACIJSA-N 0 3 314.360 4.462 20 5 DIBDHN CC(C)C[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC001167548845 1038584399 /nfs/dbraw/zinc/58/43/99/1038584399.db2.gz IZAWVYCHLNFLMA-HNNXBMFYSA-N 0 3 320.433 4.250 20 5 DIBDHN CCSc1cccc(CNCc2cccc([N+](=O)[O-])c2C)c1 ZINC000480449592 1039940712 /nfs/dbraw/zinc/94/07/12/1039940712.db2.gz ZVXNXHDXUZHFOV-UHFFFAOYSA-N 0 3 316.426 4.305 20 5 DIBDHN COc1cc(CN[C@H](C)c2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000492935769 1040042981 /nfs/dbraw/zinc/04/29/81/1040042981.db2.gz HOJZCNSUKCKMKO-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)Cc1ccsc1 ZINC000615833470 1040627375 /nfs/dbraw/zinc/62/73/75/1040627375.db2.gz MGNISZAKMCHMKP-MDWZMJQESA-N 0 3 302.399 4.192 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CNC1(c2ccc(F)cc2)CCC1 ZINC000612580131 1040647162 /nfs/dbraw/zinc/64/71/62/1040647162.db2.gz UDJSFEBVBSSXMP-UHFFFAOYSA-N 0 3 314.360 4.211 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000172831462 1040858363 /nfs/dbraw/zinc/85/83/63/1040858363.db2.gz OVYWJCCNEVHARN-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@@H](N[C@@H]1CCCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000092856835 1041118628 /nfs/dbraw/zinc/11/86/28/1041118628.db2.gz KCXHVUFFBZMMBM-KZULUSFZSA-N 0 3 314.360 4.462 20 5 DIBDHN CSCc1cccc(CNCc2ccc([N+](=O)[O-])cc2C)c1 ZINC000189477012 1041305539 /nfs/dbraw/zinc/30/55/39/1041305539.db2.gz CLFVMQCBBGSMMH-UHFFFAOYSA-N 0 3 316.426 4.056 20 5 DIBDHN Cc1ccc(CNC(C)(C)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000103173290 1041323463 /nfs/dbraw/zinc/32/34/63/1041323463.db2.gz ZVDYSFGHWFONSZ-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN C[C@@H](N[C@H](c1cccs1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555726 1041962984 /nfs/dbraw/zinc/96/29/84/1041962984.db2.gz GUHYFHPUDGEJCX-HWPZZCPQSA-N 0 3 317.414 4.040 20 5 DIBDHN Cc1cccc([C@@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1C ZINC000815580488 1041966364 /nfs/dbraw/zinc/96/63/64/1041966364.db2.gz LEFAYFIIUPJVMQ-ZIAGYGMSSA-N 0 3 313.401 4.206 20 5 DIBDHN CCC[C@H](NCc1cnc(C)cc1C)c1cccc([N+](=O)[O-])c1 ZINC000397091960 1042175671 /nfs/dbraw/zinc/17/56/71/1042175671.db2.gz KNFLWYPNCXRUHF-SFHVURJKSA-N 0 3 313.401 4.238 20 5 DIBDHN CC[C@@](C)(NCc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000107717970 1042303367 /nfs/dbraw/zinc/30/33/67/1042303367.db2.gz AUNOJCHNROFWEE-GOSISDBHSA-N 0 3 314.385 4.018 20 5 DIBDHN CC[C@@H](NCc1cccc2cc[nH]c21)c1cccc([N+](=O)[O-])c1 ZINC000237018645 1042583610 /nfs/dbraw/zinc/58/36/10/1042583610.db2.gz UFDXXLDLIQMHOK-QGZVFWFLSA-N 0 3 309.369 4.317 20 5 DIBDHN Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000519180041 1042936577 /nfs/dbraw/zinc/93/65/77/1042936577.db2.gz GZXWOLHAVHWWSS-QZTJIDSGSA-N 0 3 308.381 4.168 20 5 DIBDHN C[C@@H](NCc1ccc(C(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000184927849 1043193014 /nfs/dbraw/zinc/19/30/14/1043193014.db2.gz OVXAJYCANSUTQV-LLVKDONJSA-N 0 3 306.312 4.383 20 5 DIBDHN CCCNc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000193358229 1043284435 /nfs/dbraw/zinc/28/44/35/1043284435.db2.gz VAWDMBQFJFTFLV-CQSZACIVSA-N 0 3 313.401 4.268 20 5 DIBDHN COc1cccc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000268803130 1043333529 /nfs/dbraw/zinc/33/35/29/1043333529.db2.gz QUNVVCBXZKHHLH-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1ccccc1CN(Cc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000521198122 1043374630 /nfs/dbraw/zinc/37/46/30/1043374630.db2.gz CNPVZKTYYHTMRD-UHFFFAOYSA-N 0 3 310.397 4.376 20 5 DIBDHN CCOc1ccc([C@@H](C)NCc2sccc2C)cc1[N+](=O)[O-] ZINC000271065345 1043402737 /nfs/dbraw/zinc/40/27/37/1043402737.db2.gz CZKZTUMMMFXCMJ-GFCCVEGCSA-N 0 3 320.414 4.214 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](OC2CCC2)CC1 ZINC000872278763 1043490088 /nfs/dbraw/zinc/49/00/88/1043490088.db2.gz ZXVMWMRDZVAPBG-ZBFHGGJFSA-N 0 3 318.417 4.079 20 5 DIBDHN CC[C@@H](c1cccc(OC)c1)N(C)Cc1cccc([N+](=O)[O-])c1 ZINC000521938739 1043509290 /nfs/dbraw/zinc/50/92/90/1043509290.db2.gz OJIJLTYPUOANIX-SFHVURJKSA-N 0 3 314.385 4.187 20 5 DIBDHN CC[C@H](N[C@@H](C)c1ccc2n[nH]cc2c1)c1cccc([N+](=O)[O-])c1 ZINC000353970131 1043666292 /nfs/dbraw/zinc/66/62/92/1043666292.db2.gz BXBFGGQYZCGTRF-SJCJKPOMSA-N 0 3 324.384 4.273 20 5 DIBDHN CCN(Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000778375538 1044353699 /nfs/dbraw/zinc/35/36/99/1044353699.db2.gz ULQRYTKPTGBUDJ-GFCCVEGCSA-N 0 3 322.405 4.249 20 5 DIBDHN CCN(Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000778375541 1044355408 /nfs/dbraw/zinc/35/54/08/1044355408.db2.gz ULQRYTKPTGBUDJ-LBPRGKRZSA-N 0 3 322.405 4.249 20 5 DIBDHN CC[C@@H](Cc1ccccc1)N(CC)Cc1csc([N+](=O)[O-])c1 ZINC001168069127 1044480386 /nfs/dbraw/zinc/48/03/86/1044480386.db2.gz SORQCQCZVZPXHV-INIZCTEOSA-N 0 3 318.442 4.500 20 5 DIBDHN CC[C@H](Cc1ccccc1)N(CC)Cc1csc([N+](=O)[O-])c1 ZINC001168069129 1044480910 /nfs/dbraw/zinc/48/09/10/1044480910.db2.gz SORQCQCZVZPXHV-MRXNPFEDSA-N 0 3 318.442 4.500 20 5 DIBDHN Cc1c(CNCc2cc3c(s2)CCCC3)cccc1[N+](=O)[O-] ZINC001649166661 1044546209 /nfs/dbraw/zinc/54/62/09/1044546209.db2.gz WDNFFFSFRBGLIP-UHFFFAOYSA-N 0 3 316.426 4.133 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](N[C@H]2CC[C@H](F)C2)c2ccccc2)c1 ZINC000577239115 1045109583 /nfs/dbraw/zinc/10/95/83/1045109583.db2.gz LXXHDARKXRNGQC-XYJFISCASA-N 0 3 314.360 4.164 20 5 DIBDHN CCc1ccc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000447546483 1045145434 /nfs/dbraw/zinc/14/54/34/1045145434.db2.gz WJTZMFIAYHNLGV-QGZVFWFLSA-N 0 3 316.426 4.386 20 5 DIBDHN Cc1c(CN2CC[C@@H](c3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000579624568 1045326039 /nfs/dbraw/zinc/32/60/39/1045326039.db2.gz LWGPMXHJFAXBNA-MRXNPFEDSA-N 0 3 314.360 4.032 20 5 DIBDHN Cc1c(CN2CC[C@H](c3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000579624567 1045326347 /nfs/dbraw/zinc/32/63/47/1045326347.db2.gz LWGPMXHJFAXBNA-INIZCTEOSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@H]1[C@@H](c2ccccc2)CCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000751500025 1045607049 /nfs/dbraw/zinc/60/70/49/1045607049.db2.gz NGZZCUHUSWXKAX-GUYCJALGSA-N 0 3 314.360 4.112 20 5 DIBDHN CC[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(C)cc1 ZINC000801526808 1045729885 /nfs/dbraw/zinc/72/98/85/1045729885.db2.gz XTDBXEXACRIXCK-MRXNPFEDSA-N 0 3 302.349 4.283 20 5 DIBDHN Cc1cccc([C@H]2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)C2)c1 ZINC000801539424 1045733504 /nfs/dbraw/zinc/73/35/04/1045733504.db2.gz GLBHKZCWQVIAOX-INIZCTEOSA-N 0 3 314.360 4.032 20 5 DIBDHN COc1cc([C@@H](C)N[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000903056595 1046150866 /nfs/dbraw/zinc/15/08/66/1046150866.db2.gz WFJNHOYVAWYIGY-QWHCGFSZSA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@H](N[C@H]1CCSC(C)(C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000903280031 1046219448 /nfs/dbraw/zinc/21/94/48/1046219448.db2.gz AHCHTQHKMIYKBZ-QWRGUYRKSA-N 0 3 312.410 4.059 20 5 DIBDHN C[C@@H](N[C@H]1CCSC(C)(C)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000903280029 1046220588 /nfs/dbraw/zinc/22/05/88/1046220588.db2.gz AHCHTQHKMIYKBZ-MNOVXSKESA-N 0 3 312.410 4.059 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H](c2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000903427633 1046276581 /nfs/dbraw/zinc/27/65/81/1046276581.db2.gz IAVIBHDZAOEWHC-SCLBCKFNSA-N 0 3 311.385 4.100 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H](c1ccncc1)C1CC1)CCC2 ZINC000903427810 1046277353 /nfs/dbraw/zinc/27/73/53/1046277353.db2.gz KFHHBCASQSMKEM-RTBURBONSA-N 0 3 323.396 4.108 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](c1ccncc1)C1CC1 ZINC000903430056 1046278924 /nfs/dbraw/zinc/27/89/24/1046278924.db2.gz XJCXSUCWKMNNKL-ACJLOTCBSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1nc([C@H](C)NC[C@@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000897466214 1046439908 /nfs/dbraw/zinc/43/99/08/1046439908.db2.gz PUFDJYAAYATYFD-MNOVXSKESA-N 0 3 319.430 4.122 20 5 DIBDHN CC[C@@H](CC(F)(F)F)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783674966 1046621015 /nfs/dbraw/zinc/62/10/15/1046621015.db2.gz SOPVMJOOZQITHH-VIFPVBQESA-N 0 3 310.703 4.069 20 5 DIBDHN C[C@@H](C1CC1)N(Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000302836509 1046805590 /nfs/dbraw/zinc/80/55/90/1046805590.db2.gz GXJPEXJPPRQILM-HNNXBMFYSA-N 0 3 310.397 4.396 20 5 DIBDHN CO[C@H]1CN(Cc2c3ccccc3cc3ccccc32)C[C@@H]1F ZINC001141723419 1047277921 /nfs/dbraw/zinc/27/79/21/1047277921.db2.gz XABDLKGBPIECOB-PMACEKPBSA-N 0 3 309.384 4.162 20 5 DIBDHN COC(=O)[C@@H]1CCCN1Cc1c2ccccc2cc2ccccc21 ZINC001141722907 1047279170 /nfs/dbraw/zinc/27/91/70/1047279170.db2.gz JTCNXBZBTATBQG-FQEVSTJZSA-N 0 3 319.404 4.130 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CNC1(c2cccc(F)c2)CC1 ZINC000538418413 1047675223 /nfs/dbraw/zinc/67/52/23/1047675223.db2.gz IQQVIVMYNPJRDK-XQRVVYSFSA-N 0 3 312.344 4.026 20 5 DIBDHN C[C@H](N[C@H]1CCSC2(CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000927035436 1047766277 /nfs/dbraw/zinc/76/62/77/1047766277.db2.gz GPIRTKRTLCGXMF-RYUDHWBXSA-N 0 3 324.421 4.203 20 5 DIBDHN Cc1cc(CNCc2cccc([N+](=O)[O-])c2C)cc2cccnc12 ZINC000480440993 1048143388 /nfs/dbraw/zinc/14/33/88/1048143388.db2.gz GHFLAYYOQNKIDL-UHFFFAOYSA-N 0 3 321.380 4.050 20 5 DIBDHN Cc1cc(Cl)cc(C)c1CNCc1cccc([N+](=O)[O-])c1C ZINC000480483182 1048151232 /nfs/dbraw/zinc/15/12/32/1048151232.db2.gz UEMXQMBRNPNFQP-UHFFFAOYSA-N 0 3 318.804 4.463 20 5 DIBDHN CC[C@](C)(NCc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001175240383 1048213029 /nfs/dbraw/zinc/21/30/29/1048213029.db2.gz YZOWOOHPQFNVNZ-SFHVURJKSA-N 0 3 316.376 4.457 20 5 DIBDHN Cc1cc(C)c([N+](=O)[O-])c(NCCP(C(C)C)C(C)C)n1 ZINC001162361722 1048267802 /nfs/dbraw/zinc/26/78/02/1048267802.db2.gz CDUJUBLLPLSYFO-UHFFFAOYSA-N 0 3 311.366 4.317 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CNCc1ccc(C(C)(F)F)cc1 ZINC000555593721 1048398461 /nfs/dbraw/zinc/39/84/61/1048398461.db2.gz MNXJXWXXCHJVPQ-UHFFFAOYSA-N 0 3 320.339 4.305 20 5 DIBDHN CSCc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC001201988758 1048424706 /nfs/dbraw/zinc/42/47/06/1048424706.db2.gz HBVDKXJGKVARNQ-UHFFFAOYSA-N 0 3 316.426 4.056 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC2 ZINC001176036362 1048540303 /nfs/dbraw/zinc/54/03/03/1048540303.db2.gz KNHWSTCVZMSAQY-UONOGXRCSA-N 0 3 310.397 4.495 20 5 DIBDHN CCC[C@@]1(C)CCCN(Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001191258522 1048896572 /nfs/dbraw/zinc/89/65/72/1048896572.db2.gz NLOWBOGZXLYKLB-KRWDZBQOSA-N 0 3 306.406 4.006 20 5 DIBDHN Cc1ccc(CNCc2cccc(Cl)c2C)cc1[N+](=O)[O-] ZINC001179391446 1049162056 /nfs/dbraw/zinc/16/20/56/1049162056.db2.gz UCSWKTAQSZKTMA-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN C[C@H](NC/C=C/c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC001179578993 1049179531 /nfs/dbraw/zinc/17/95/31/1049179531.db2.gz GFYSOZTYNKXASN-IBUXWKBASA-N 0 3 300.333 4.098 20 5 DIBDHN CC(C)(NC/C=C/c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001205290818 1049429144 /nfs/dbraw/zinc/42/91/44/1049429144.db2.gz BXOWZONTWYVLHQ-GQCTYLIASA-N 0 3 314.360 4.272 20 5 DIBDHN CCN(Cc1ccc(OC)cc1)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000488495472 1049661413 /nfs/dbraw/zinc/66/14/13/1049661413.db2.gz QEKOTIRHQSLVML-CQSZACIVSA-N 0 3 314.385 4.187 20 5 DIBDHN Cc1ccc(C[C@H](C)N(C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000738330056 1050531573 /nfs/dbraw/zinc/53/15/73/1050531573.db2.gz GALJEMISIAQXCZ-AWEZNQCLSA-N 0 3 316.376 4.105 20 5 DIBDHN COc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)c1C ZINC000595106280 1050607050 /nfs/dbraw/zinc/60/70/50/1050607050.db2.gz RRKHSEGKMMIVGL-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788496698 1050692646 /nfs/dbraw/zinc/69/26/46/1050692646.db2.gz AOKNYUFQOQIGKT-MNOVXSKESA-N 0 3 319.792 4.242 20 5 DIBDHN Cc1ccc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000060041956 1050695736 /nfs/dbraw/zinc/69/57/36/1050695736.db2.gz TVFVXHIGRUEJEE-UHFFFAOYSA-N 0 3 304.415 4.375 20 5 DIBDHN Cc1cc(C)cc([C@@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788596681 1050711152 /nfs/dbraw/zinc/71/11/52/1050711152.db2.gz ZZKQMQZAPHZJFQ-ZIAGYGMSSA-N 0 3 313.401 4.206 20 5 DIBDHN Cc1cc([C@@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)ccc1F ZINC000788667731 1050730443 /nfs/dbraw/zinc/73/04/43/1050730443.db2.gz HZFDHYDFORTCJX-VXGBXAGGSA-N 0 3 317.364 4.036 20 5 DIBDHN CCN(Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@H](C)C(C)C ZINC000742549865 1050884993 /nfs/dbraw/zinc/88/49/93/1050884993.db2.gz FZAYOKQMMPAZNI-LLVKDONJSA-N 0 3 323.418 4.196 20 5 DIBDHN C[C@H](N[C@H]1CC[C@H](C[N+](=O)[O-])C1)c1c(Cl)cccc1Cl ZINC001168978358 1051475656 /nfs/dbraw/zinc/47/56/56/1051475656.db2.gz RHJBAVQIVYUDDS-DCAQKATOSA-N 0 3 317.216 4.089 20 5 DIBDHN CCC1(CC)CCCN(Cc2cc([N+](=O)[O-])ccc2OC)CC1 ZINC001169301857 1051579989 /nfs/dbraw/zinc/57/99/89/1051579989.db2.gz ZUFHVFVONIGDGT-UHFFFAOYSA-N 0 3 320.433 4.396 20 5 DIBDHN CC[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC000761520651 1051587113 /nfs/dbraw/zinc/58/71/13/1051587113.db2.gz DCYVJKBKOANLGV-HNNXBMFYSA-N 0 3 304.777 4.489 20 5 DIBDHN Cc1ccc2c(c1)[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)CC2 ZINC000761520239 1051587215 /nfs/dbraw/zinc/58/72/15/1051587215.db2.gz NDDFLYPWVRQWPO-INIZCTEOSA-N 0 3 316.788 4.334 20 5 DIBDHN CC[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC000761520653 1051587803 /nfs/dbraw/zinc/58/78/03/1051587803.db2.gz DCYVJKBKOANLGV-OAHLLOKOSA-N 0 3 304.777 4.489 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC/C=C\c2ccccc2)cc1Cl ZINC000761531733 1051590096 /nfs/dbraw/zinc/59/00/96/1051590096.db2.gz JPRLWRIQIIJVGV-DAXSKMNVSA-N 0 3 302.761 4.051 20 5 DIBDHN CC(C)c1ccc2c(c1)[C@H](NCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000495156123 1052238794 /nfs/dbraw/zinc/23/87/94/1052238794.db2.gz LIKGNSRJJVUTTM-LJQANCHMSA-N 0 3 310.397 4.495 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193900915 1052510612 /nfs/dbraw/zinc/51/06/12/1052510612.db2.gz ZHSOPGIUEYCQEK-OLZOCXBDSA-N 0 3 300.358 4.015 20 5 DIBDHN CCN(CCc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705239 1052988549 /nfs/dbraw/zinc/98/85/49/1052988549.db2.gz KLYMBDYDCKHUDQ-UHFFFAOYSA-N 0 3 318.804 4.313 20 5 DIBDHN Cc1ccncc1[C@@H](C)N[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571381 1053325571 /nfs/dbraw/zinc/32/55/71/1053325571.db2.gz HEQSBXAURNXGSZ-ACJLOTCBSA-N 0 3 311.385 4.026 20 5 DIBDHN C[C@@H](N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000619754174 1053548688 /nfs/dbraw/zinc/54/86/88/1053548688.db2.gz LUKXPAZBTFQZCU-BDJLRTHQSA-N 0 3 302.399 4.385 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1ccc(Cl)cc1 ZINC000152919077 1053549952 /nfs/dbraw/zinc/54/99/52/1053549952.db2.gz LKSHDTQFKYDKDT-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN Cc1ccc([C@@H](C)NC/C=C/c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001200810692 1053997312 /nfs/dbraw/zinc/99/73/12/1053997312.db2.gz AAMYRGILJFACSN-RDFMZFSFSA-N 0 3 314.360 4.406 20 5 DIBDHN Cc1ccc([C@H](C)NC/C=C/c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001200810695 1053998672 /nfs/dbraw/zinc/99/86/72/1053998672.db2.gz AAMYRGILJFACSN-XGACYXMMSA-N 0 3 314.360 4.406 20 5 DIBDHN CC[C@@H](NCc1ccc(F)c(C)c1)c1cccc([N+](=O)[O-])c1 ZINC001620863416 1055492651 /nfs/dbraw/zinc/49/26/51/1055492651.db2.gz OUZOJRMSGYOKSV-QGZVFWFLSA-N 0 3 302.349 4.283 20 5 DIBDHN CC[C@@H](NCc1ccc(C(C)C)c([N+](=O)[O-])c1)c1ccncc1 ZINC001620810085 1056003897 /nfs/dbraw/zinc/00/38/97/1056003897.db2.gz CIIDFZLZHNECPO-QGZVFWFLSA-N 0 3 313.401 4.354 20 5 DIBDHN CC[C@@H](C)N[C@@H](CNc1cc(C)sc1[N+](=O)[O-])c1ccco1 ZINC001612367583 1056279461 /nfs/dbraw/zinc/27/94/61/1056279461.db2.gz HHLXIUBPNLQGOU-MFKMUULPSA-N 0 3 323.418 4.099 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN(CC1CCCCC1)C1CC1 ZINC001615215393 1056478210 /nfs/dbraw/zinc/47/82/10/1056478210.db2.gz SWTQTVYHIBOJKA-UHFFFAOYSA-N 0 3 318.417 4.148 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](C(C)C)C1 ZINC001617272958 1056804818 /nfs/dbraw/zinc/80/48/18/1056804818.db2.gz GSRAASJJDKDKFK-OAHLLOKOSA-N 0 3 320.433 4.250 20 5 DIBDHN c1ccc2c(c1)cc(-c1ncc3c(n1)CCNC3)c1ccccc21 ZINC001241133048 1056915640 /nfs/dbraw/zinc/91/56/40/1056915640.db2.gz SZJRIRQQXAAVSB-UHFFFAOYSA-N 0 3 311.388 4.096 20 5 DIBDHN CN(C)CCc1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001247446698 1059484828 /nfs/dbraw/zinc/48/48/28/1059484828.db2.gz QYTZRZRVTCTZDH-UHFFFAOYSA-N 0 3 317.392 4.147 20 5 DIBDHN CCC1(CC)CN([C@@H](C)c2ccccc2[N+](=O)[O-])CCS1 ZINC001559729507 1059563807 /nfs/dbraw/zinc/56/38/07/1059563807.db2.gz ZMNAJAGHPCJLHN-ZDUSSCGKSA-N 0 3 308.447 4.263 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CCC(C)(C)CC(C)(C)C1 ZINC001559987685 1059792877 /nfs/dbraw/zinc/79/28/77/1059792877.db2.gz RHATWHNGWBEHSV-UHFFFAOYSA-N 0 3 320.433 4.252 20 5 DIBDHN COc1ccc(Nc2ccnc(C(C)(C)C)c2)c([N+](=O)[O-])c1 ZINC001248466422 1059846826 /nfs/dbraw/zinc/84/68/26/1059846826.db2.gz RUCPQRBKHQMACV-UHFFFAOYSA-N 0 3 301.346 4.040 20 5 DIBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@H]1C1CCCCC1 ZINC001560359201 1060146657 /nfs/dbraw/zinc/14/66/57/1060146657.db2.gz FEKGEMHQJCCZNQ-IRXDYDNUSA-N 0 3 318.417 4.052 20 5 DIBDHN C[C@H](CNCc1cscc1Cl)c1ccccc1[N+](=O)[O-] ZINC001560604365 1060417177 /nfs/dbraw/zinc/41/71/77/1060417177.db2.gz URQMMHIRKNSSBW-SNVBAGLBSA-N 0 3 310.806 4.203 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCc2c(C)cccc2C1 ZINC001560684580 1060531161 /nfs/dbraw/zinc/53/11/61/1060531161.db2.gz ROLWLOAZFBDXHY-PTNGSMBKSA-N 0 3 322.408 4.365 20 5 DIBDHN O=[N+]([O-])c1cccc(CN2C[C@H]3CCCC[C@]32c2ccccc2)c1 ZINC001473229543 1061010403 /nfs/dbraw/zinc/01/04/03/1061010403.db2.gz ANCYWTJFJDJUPM-QUCCMNQESA-N 0 3 322.408 4.496 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N1CCC=C(c2ccccc2)C1 ZINC001473464672 1061173983 /nfs/dbraw/zinc/17/39/83/1061173983.db2.gz LYKOXXBQJCDZEY-OAHLLOKOSA-N 0 3 308.381 4.445 20 5 DIBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC001473462484 1061174965 /nfs/dbraw/zinc/17/49/65/1061174965.db2.gz KIGKNUXXBPUYOY-UHFFFAOYSA-N 0 3 322.767 4.062 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCC[C@H]1CC1CCC1 ZINC001473662412 1061324372 /nfs/dbraw/zinc/32/43/72/1061324372.db2.gz BJENOMTYVRFKOT-INIZCTEOSA-N 0 3 306.381 4.279 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](C2CCC2)CC1 ZINC001473740236 1061382607 /nfs/dbraw/zinc/38/26/07/1061382607.db2.gz DCSHJWFCQRMBCC-OAHLLOKOSA-N 0 3 318.417 4.006 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](C2CCC2)CC1 ZINC001473740235 1061382722 /nfs/dbraw/zinc/38/27/22/1061382722.db2.gz DCSHJWFCQRMBCC-HNNXBMFYSA-N 0 3 318.417 4.006 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1CN[C@H]1C[C@H](c2ccccc2)C1 ZINC001474485878 1062163694 /nfs/dbraw/zinc/16/36/94/1062163694.db2.gz WFOQAVHPRILQMN-KOMQPUFPSA-N 0 3 316.788 4.284 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1c(F)cccc1Cl ZINC001254534689 1062164003 /nfs/dbraw/zinc/16/40/03/1062164003.db2.gz BBPHYAQOMHVPGE-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN CCCN(Cc1ccccc1[N+](=O)[O-])[C@@H]1C[C@@H](OCC)C1(C)C ZINC001459520833 1062180463 /nfs/dbraw/zinc/18/04/63/1062180463.db2.gz ANTCZQLHPWANDT-IAGOWNOFSA-N 0 3 320.433 4.010 20 5 DIBDHN C[C@H]1[C@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC001459623604 1062257520 /nfs/dbraw/zinc/25/75/20/1062257520.db2.gz MEHJQNHWXLJYLV-SUMWQHHRSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@H]1[C@@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC001459623602 1062259450 /nfs/dbraw/zinc/25/94/50/1062259450.db2.gz MEHJQNHWXLJYLV-GUYCJALGSA-N 0 3 314.360 4.112 20 5 DIBDHN Cc1ccc([C@H](C)NCc2ccc3ncccc3c2)cc1[N+](=O)[O-] ZINC001459824275 1062428723 /nfs/dbraw/zinc/42/87/23/1062428723.db2.gz JKOQSQSCSSFGRD-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CC1(C)CCC[C@@H]1[C@@H]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001460295347 1062765805 /nfs/dbraw/zinc/76/58/05/1062765805.db2.gz IKKMDUDRZFVEOY-CZUORRHYSA-N 0 3 320.408 4.382 20 5 DIBDHN C[C@H](CSc1ccccc1)N(C)Cc1cccc([N+](=O)[O-])c1 ZINC001460357815 1062803119 /nfs/dbraw/zinc/80/31/19/1062803119.db2.gz DGQIZOCWVAQYAO-CQSZACIVSA-N 0 3 316.426 4.207 20 5 DIBDHN CC(C)(NCc1cccc(C2CC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC001462058543 1063908780 /nfs/dbraw/zinc/90/87/80/1063908780.db2.gz JQFLQPDASOADJU-UHFFFAOYSA-N 0 3 310.397 4.497 20 5 DIBDHN Cc1ccccc1[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001307444721 1065405320 /nfs/dbraw/zinc/40/53/20/1065405320.db2.gz YDUQWYVIQKYPAF-CQSZACIVSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@@H]1CC(C)(C)CC[C@H]1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC001307704625 1065574328 /nfs/dbraw/zinc/57/43/28/1065574328.db2.gz DKYQOMAVLVENCP-MEBBXXQBSA-N 0 3 312.360 4.177 20 5 DIBDHN C[C@@H](c1ccccc1Cl)N(C)CCc1ccccc1[N+](=O)[O-] ZINC001307759771 1065609710 /nfs/dbraw/zinc/60/97/10/1065609710.db2.gz CTJHREOSFTVNGM-ZDUSSCGKSA-N 0 3 318.804 4.484 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC/C=C\Cl)s2)cc1 ZINC001308542394 1066058866 /nfs/dbraw/zinc/05/88/66/1066058866.db2.gz AOTQVJKKIOQRRF-QPIMQUGISA-N 0 3 308.790 4.165 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000903289820 1066103439 /nfs/dbraw/zinc/10/34/39/1066103439.db2.gz YEYLPKBFFNFMOG-UONOGXRCSA-N 0 3 313.401 4.073 20 5 DIBDHN C[C@H]1CC(C)(C)CN1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001308821992 1066296743 /nfs/dbraw/zinc/29/67/43/1066296743.db2.gz YBKXKWFIZLZKHR-JTQLQIEISA-N 0 3 316.323 4.234 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CC([C@H]2CCC[C@@H](C)C2)C1 ZINC001308911068 1066390834 /nfs/dbraw/zinc/39/08/34/1066390834.db2.gz DAEVDCFIUFAKJI-CJNGLKHVSA-N 0 3 316.445 4.470 20 5 DIBDHN C[C@@H](N[C@@H]1CCCc2sccc21)c1ccc([N+](=O)[O-])cc1 ZINC000061359970 184169038 /nfs/dbraw/zinc/16/90/38/184169038.db2.gz XKBFJSKLYFGYKP-IAQYHMDHSA-N 0 3 302.399 4.385 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(OC(C)(C)C)CC1 ZINC000272407567 130027155 /nfs/dbraw/zinc/02/71/55/130027155.db2.gz ZZLKSXIJZJHBMO-CQSZACIVSA-N 0 3 320.433 4.244 20 5 DIBDHN Cc1ccccc1C(C)(C)NCc1ccc([N+](=O)[O-])c(F)c1 ZINC000292830322 131680596 /nfs/dbraw/zinc/68/05/96/131680596.db2.gz AMWRIWLTKIPLRO-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN CSCCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180575299 331573216 /nfs/dbraw/zinc/57/32/16/331573216.db2.gz VOXNQALKKPEGBP-QGZVFWFLSA-N 0 3 316.426 4.027 20 5 DIBDHN CC[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000317413544 331773104 /nfs/dbraw/zinc/77/31/04/331773104.db2.gz 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333239150 /nfs/dbraw/zinc/23/91/50/333239150.db2.gz WCSHTJWLJLHFSE-UHFFFAOYSA-N 0 3 312.413 4.491 20 5 DIBDHN CC[C@@H](NCCCOc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390570242 333301680 /nfs/dbraw/zinc/30/16/80/333301680.db2.gz OICMLASUBMUKKS-GOSISDBHSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCCOc1ccccc1 ZINC000531690478 333545361 /nfs/dbraw/zinc/54/53/61/333545361.db2.gz GFESZXAMELQJBW-OAHLLOKOSA-N 0 3 314.385 4.023 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000414062316 333889266 /nfs/dbraw/zinc/88/92/66/333889266.db2.gz CMSPEZUZIGWWQJ-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1c([C@@H](C)NCCCOc2ccccc2)cccc1[N+](=O)[O-] ZINC000531945880 334301153 /nfs/dbraw/zinc/30/11/53/334301153.db2.gz KZFJFNDRHYHUAW-OAHLLOKOSA-N 0 3 314.385 4.023 20 5 DIBDHN CC[C@H](NCCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000534696719 334327695 /nfs/dbraw/zinc/32/76/95/334327695.db2.gz OYLHGUJCPAOOIY-KRWDZBQOSA-N 0 3 320.339 4.156 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2C3CCC2CC3)s1 ZINC000535066374 334363001 /nfs/dbraw/zinc/36/30/01/334363001.db2.gz OEJQUAPVWYWQNK-UHFFFAOYSA-N 0 3 314.410 4.450 20 5 DIBDHN CC1(C)Cc2occc2[C@H](NCCc2ccccc2[N+](=O)[O-])C1 ZINC000344089034 335217119 /nfs/dbraw/zinc/21/71/19/335217119.db2.gz LKBJYAHAZRWHDM-OAHLLOKOSA-N 0 3 314.385 4.034 20 5 DIBDHN Cc1c2ccccc2n(C)c1CN[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000326905350 335651229 /nfs/dbraw/zinc/65/12/29/335651229.db2.gz LVSMXVFDZFXWQR-AWEZNQCLSA-N 0 3 323.396 4.246 20 5 DIBDHN CCO[C@H](CN[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000193432499 336896960 /nfs/dbraw/zinc/89/69/60/336896960.db2.gz PBLNRNZRBWSEJC-RDTXWAMCSA-N 0 3 314.385 4.023 20 5 DIBDHN CCO[C@H](CN[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000193522564 337038246 /nfs/dbraw/zinc/03/82/46/337038246.db2.gz PVBUIDRROOWTCK-RDTXWAMCSA-N 0 3 314.385 4.023 20 5 DIBDHN CCCOc1ccc([C@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000193701103 337079160 /nfs/dbraw/zinc/07/91/60/337079160.db2.gz PYITYOLNONVSBN-AWEZNQCLSA-N 0 3 314.385 4.234 20 5 DIBDHN CC[C@H](NCc1cc(C)cc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000181616334 337183366 /nfs/dbraw/zinc/18/33/66/337183366.db2.gz AVDIWRXDGACEDB-SFHVURJKSA-N 0 3 314.385 4.153 20 5 DIBDHN C[C@@H](Cc1cccs1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000071269824 337851966 /nfs/dbraw/zinc/85/19/66/337851966.db2.gz NKNODXFLMOGCKZ-JTQLQIEISA-N 0 3 310.806 4.031 20 5 DIBDHN Cc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1F ZINC000119086410 337854202 /nfs/dbraw/zinc/85/42/02/337854202.db2.gz HJDRMEYNCUCFIB-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN CC(C)(NC/C=C\c1ccccc1[N+](=O)[O-])c1cccs1 ZINC000537306419 337930029 /nfs/dbraw/zinc/93/00/29/337930029.db2.gz HANFDXCYDLWSJV-YVMONPNESA-N 0 3 302.399 4.194 20 5 DIBDHN CC(C)c1ccc(CN2CCS[C@H](C)CC2)cc1[N+](=O)[O-] ZINC000426380800 338029758 /nfs/dbraw/zinc/02/97/58/338029758.db2.gz WWHREBKFYBFTRW-CYBMUJFWSA-N 0 3 308.447 4.046 20 5 DIBDHN CC(C)(NCCSc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000429268335 338075414 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20 5 DIBDHN CSC(C)(C)CNc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC000167385641 339053550 /nfs/dbraw/zinc/05/35/50/339053550.db2.gz NQFCCMSHJONSIR-UHFFFAOYSA-N 0 3 305.403 4.005 20 5 DIBDHN C[C@@H]1CCCc2ccccc2[C@@H]1NCc1cccc([N+](=O)[O-])c1 ZINC000462542177 339080913 /nfs/dbraw/zinc/08/09/13/339080913.db2.gz LBSOTWQFHBFQMP-AUUYWEPGSA-N 0 3 310.397 4.398 20 5 DIBDHN C[C@@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000464849773 339157688 /nfs/dbraw/zinc/15/76/88/339157688.db2.gz IQYLYRVVVDPGQN-PBHICJAKSA-N 0 3 314.385 4.204 20 5 DIBDHN C[C@@H]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000464849774 339157747 /nfs/dbraw/zinc/15/77/47/339157747.db2.gz IQYLYRVVVDPGQN-RHSMWYFYSA-N 0 3 314.385 4.204 20 5 DIBDHN C[C@H](CN[C@@H](C)c1cccc([N+](=O)[O-])c1)Sc1ccccc1 ZINC000467856866 339247762 /nfs/dbraw/zinc/24/77/62/339247762.db2.gz SHXNAMPYFTXMLC-KGLIPLIRSA-N 0 3 316.426 4.426 20 5 DIBDHN C[C@@H](NCCc1cccc([N+](=O)[O-])c1)c1csc(Cl)c1 ZINC000469235514 339283709 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Cc1ccc(O[C@H](C)CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000483631050 339670106 /nfs/dbraw/zinc/67/01/06/339670106.db2.gz CJLKDHNXRTUIQP-CABCVRRESA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccc(C[C@@H]2CCCN2Cc2csc([N+](=O)[O-])c2)cc1 ZINC000500210929 340053008 /nfs/dbraw/zinc/05/30/08/340053008.db2.gz SMBRCFPFCLEUHF-INIZCTEOSA-N 0 3 316.426 4.172 20 5 DIBDHN Cc1c2ccccc2n(C)c1CN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000479459601 340151794 /nfs/dbraw/zinc/15/17/94/340151794.db2.gz XUAMNHBAFOSTTM-CQSZACIVSA-N 0 3 323.396 4.246 20 5 DIBDHN CC[C@H](CSc1ccccc1[N+](=O)[O-])NCc1ccsc1 ZINC000504920070 340156213 /nfs/dbraw/zinc/15/62/13/340156213.db2.gz MSRUNTNZZYZQLN-CYBMUJFWSA-N 0 3 322.455 4.317 20 5 DIBDHN CC[C@H](c1cccc(OC)c1)N(C)Cc1ccc([N+](=O)[O-])cc1 ZINC000516598640 340171300 /nfs/dbraw/zinc/17/13/00/340171300.db2.gz BYISSAKWRAILSS-GOSISDBHSA-N 0 3 314.385 4.187 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN1CCC[C@@H]1C1CCCCC1 ZINC000505853220 340179803 /nfs/dbraw/zinc/17/98/03/340179803.db2.gz IVMRGACNGCGQAI-MRXNPFEDSA-N 0 3 306.381 4.279 20 5 DIBDHN CC(C)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000505886293 340180827 /nfs/dbraw/zinc/18/08/27/340180827.db2.gz BQUBOUIFSYLYNT-UHFFFAOYSA-N 0 3 308.765 4.348 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN(CC1CC1)C1CCCCC1 ZINC000507837912 340233804 /nfs/dbraw/zinc/23/38/04/340233804.db2.gz VKOCTVUSFBXGMQ-UHFFFAOYSA-N 0 3 306.381 4.279 20 5 DIBDHN CC(C)N(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000508012043 340237332 /nfs/dbraw/zinc/23/73/32/340237332.db2.gz CBAFICAQQWRGNF-UHFFFAOYSA-N 0 3 300.358 4.228 20 5 DIBDHN CN(CCc1cccc2ccccc21)Cc1cccc([N+](=O)[O-])c1 ZINC000303160907 340307636 /nfs/dbraw/zinc/30/76/36/340307636.db2.gz TZGCEQPZSRYYSE-UHFFFAOYSA-N 0 3 320.392 4.423 20 5 DIBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc(C(F)F)cc1 ZINC000511121402 340321549 /nfs/dbraw/zinc/32/15/49/340321549.db2.gz FTFMPAFZNKYGRS-UHFFFAOYSA-N 0 3 320.339 4.207 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CCc3c2cccc3F)cc1[N+](=O)[O-] ZINC000513856854 340428767 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CC[C@@H](CC(F)(F)F)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000546165537 341155511 /nfs/dbraw/zinc/15/55/11/341155511.db2.gz CNYJMPMMAVBFST-JQWIXIFHSA-N 0 3 304.312 4.285 20 5 DIBDHN CCC(CC)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000236644056 341191607 /nfs/dbraw/zinc/19/16/07/341191607.db2.gz RJPCHMIDDMZLDO-UHFFFAOYSA-N 0 3 319.430 4.244 20 5 DIBDHN CCCOc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000079724043 341264616 /nfs/dbraw/zinc/26/46/16/341264616.db2.gz QJOUBOWWOGBYKP-AWEZNQCLSA-N 0 3 314.385 4.234 20 5 DIBDHN CCOc1cccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000080347105 341273017 /nfs/dbraw/zinc/27/30/17/341273017.db2.gz WHXNSMVLHVVIGM-UHFFFAOYSA-N 0 3 314.385 4.018 20 5 DIBDHN CC(C)c1ccc(CNCCOC2CCCCC2)cc1[N+](=O)[O-] ZINC000550851616 341324409 /nfs/dbraw/zinc/32/44/09/341324409.db2.gz BCTVWOULCBOPSA-UHFFFAOYSA-N 0 3 320.433 4.157 20 5 DIBDHN CSCc1cccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000188722933 525740700 /nfs/dbraw/zinc/74/07/00/525740700.db2.gz AFJXKWUBXQZSJB-CYBMUJFWSA-N 0 3 316.426 4.309 20 5 DIBDHN CSC[C@@H]1CCCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000430193415 1035666660 /nfs/dbraw/zinc/66/66/60/1035666660.db2.gz GCGPRNUTZJVINX-OAHLLOKOSA-N 0 3 322.474 4.293 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1cccc2cccnc21 ZINC000120516081 1035863636 /nfs/dbraw/zinc/86/36/36/1035863636.db2.gz YNLAMLONJOWDAR-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CC[C@@H](C)[C@@H](C)N(Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CC1 ZINC001167356105 1036963239 /nfs/dbraw/zinc/96/32/39/1036963239.db2.gz JKSYBZKBRWYUQV-VXGBXAGGSA-N 0 3 324.396 4.142 20 5 DIBDHN COc1ccc(CN(C)[C@H](C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000603682806 1038266839 /nfs/dbraw/zinc/26/68/39/1038266839.db2.gz APWIDUXSWMHUPQ-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000178687518 1038978880 /nfs/dbraw/zinc/97/88/80/1038978880.db2.gz AWGIHTDNNBZXFK-YVEFUNNKSA-N 0 3 314.360 4.380 20 5 DIBDHN CSCCN(C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000539829791 1039356335 /nfs/dbraw/zinc/35/63/35/1039356335.db2.gz XVHWPWNCDWLPTC-UHFFFAOYSA-N 0 3 322.455 4.118 20 5 DIBDHN Cc1ccc2c(c1)[C@H](NCc1ccc([N+](=O)[O-])cc1C)CCC2 ZINC000492176743 1039931748 /nfs/dbraw/zinc/93/17/48/1039931748.db2.gz UQPSYRSDFCOOPR-LJQANCHMSA-N 0 3 310.397 4.379 20 5 DIBDHN Cc1cc(Cl)ccc1CNCc1cccc([N+](=O)[O-])c1C ZINC000235793243 1040127413 /nfs/dbraw/zinc/12/74/13/1040127413.db2.gz SVIICEDISQTHLV-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H]1c1cccnc1 ZINC000581396391 1040854718 /nfs/dbraw/zinc/85/47/18/1040854718.db2.gz AECGVEWHEOHYHZ-FERCGXDMSA-N 0 3 323.396 4.230 20 5 DIBDHN CC1(C)CC[C@@H](NCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000236747573 1041410414 /nfs/dbraw/zinc/41/04/14/1041410414.db2.gz CICCFMYLBGPJPK-GOSISDBHSA-N 0 3 310.397 4.497 20 5 DIBDHN CSC(C)(C)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811482485 1041521321 /nfs/dbraw/zinc/52/13/21/1041521321.db2.gz YBARHDXKJRVRDO-UHFFFAOYSA-N 0 3 323.245 4.133 20 5 DIBDHN Cc1cc(F)ccc1[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000815566056 1041964010 /nfs/dbraw/zinc/96/40/10/1041964010.db2.gz HPEOIYVHAUVBDP-STQMWFEESA-N 0 3 302.349 4.454 20 5 DIBDHN CC[C@@H](C)N[C@H](CNc1ccc([N+](=O)[O-])c(C)c1)c1ccco1 ZINC000557696746 1042880942 /nfs/dbraw/zinc/88/09/42/1042880942.db2.gz WCKXEDUSKXHZCI-UKRRQHHQSA-N 0 3 317.389 4.038 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN([C@@H](C)C1CC1)C1CC1 ZINC000519160610 1042935666 /nfs/dbraw/zinc/93/56/66/1042935666.db2.gz QWJSADWUIBSUQS-ZDUSSCGKSA-N 0 3 318.417 4.145 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1F ZINC000120901697 1043034018 /nfs/dbraw/zinc/03/40/18/1043034018.db2.gz ZMGOOTKNAIASHF-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN CC[C@H](Cc1ccc(C)cc1)N(C)Cc1csc([N+](=O)[O-])c1 ZINC000441326310 1043036197 /nfs/dbraw/zinc/03/61/97/1043036197.db2.gz DZPVDVJVLPOKND-MRXNPFEDSA-N 0 3 318.442 4.418 20 5 DIBDHN CSc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178649706 1043135156 /nfs/dbraw/zinc/13/51/56/1043135156.db2.gz KFDUGDPXPQEQLO-LBPRGKRZSA-N 0 3 302.399 4.168 20 5 DIBDHN CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](C)CC(F)(F)F ZINC000872064274 1043445659 /nfs/dbraw/zinc/44/56/59/1043445659.db2.gz XPQDEHFBHWGLNR-IUCAKERBSA-N 0 3 322.352 4.308 20 5 DIBDHN C[C@H](NCC[C@@]1(C)C[C@@]1(F)Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872084476 1043454655 /nfs/dbraw/zinc/45/46/55/1043454655.db2.gz SJRHBIGUISWFFF-HERUPUMHSA-N 0 3 318.751 4.089 20 5 DIBDHN C[C@H](NCC(C)(C)C(C)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872091323 1043456381 /nfs/dbraw/zinc/45/63/81/1043456381.db2.gz GNMSTARYFUBLCC-VIFPVBQESA-N 0 3 304.312 4.066 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](OC2CCC2)CC1 ZINC000872278761 1043490743 /nfs/dbraw/zinc/49/07/43/1043490743.db2.gz ZXVMWMRDZVAPBG-GOEBONIOSA-N 0 3 318.417 4.079 20 5 DIBDHN CC(C)(C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000522196548 1043574065 /nfs/dbraw/zinc/57/40/65/1043574065.db2.gz HMURIWFOCZEWDE-UHFFFAOYSA-N 0 3 319.430 4.244 20 5 DIBDHN C[C@H](NCC(C)(C)CC(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000883260215 1044250718 /nfs/dbraw/zinc/25/07/18/1044250718.db2.gz NSHCEIVRDJVDLQ-VIFPVBQESA-N 0 3 304.312 4.066 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC[C@H](c2ccccc2)C(F)(F)F)cc1 ZINC000186438008 1044422986 /nfs/dbraw/zinc/42/29/86/1044422986.db2.gz VSIKPOXCGFQBRJ-OAHLLOKOSA-N 0 3 324.302 4.031 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](CC(F)(F)F)C1 ZINC000444708410 1044611132 /nfs/dbraw/zinc/61/11/32/1044611132.db2.gz QSCUDNFBSPOHGQ-NWDGAFQWSA-N 0 3 316.323 4.239 20 5 DIBDHN C[C@H](NCc1cccc(C(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000296777303 1044646097 /nfs/dbraw/zinc/64/60/97/1044646097.db2.gz RVFPPVVOVDPQEL-NSHDSACASA-N 0 3 306.312 4.383 20 5 DIBDHN C[C@@H](Cc1ccccc1Cl)NCc1csc([N+](=O)[O-])c1 ZINC000037562767 1044782203 /nfs/dbraw/zinc/78/22/03/1044782203.db2.gz OPDWFKPZPPSBAH-JTQLQIEISA-N 0 3 310.806 4.031 20 5 DIBDHN Cc1ccccc1[C@@H]1C[C@@H](C)N(Cc2csc([N+](=O)[O-])c2)C1 ZINC000524595051 1044881149 /nfs/dbraw/zinc/88/11/49/1044881149.db2.gz AFVLUNZJLXJAGM-UKRRQHHQSA-N 0 3 316.426 4.343 20 5 DIBDHN Cc1ccc2c(c1)[C@@H](NCc1cccc([N+](=O)[O-])c1C)[C@H](C)C2 ZINC000577442869 1045125353 /nfs/dbraw/zinc/12/53/53/1045125353.db2.gz FWDMQLIGZHZPLW-YJYMSZOUSA-N 0 3 310.397 4.235 20 5 DIBDHN Cc1ccc2c(c1)[C@H](NCc1cccc([N+](=O)[O-])c1C)[C@@H](C)C2 ZINC000577442868 1045125671 /nfs/dbraw/zinc/12/56/71/1045125671.db2.gz FWDMQLIGZHZPLW-ORAYPTAESA-N 0 3 310.397 4.235 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1ccc(Cl)cc1)CCC2 ZINC000447514275 1045139866 /nfs/dbraw/zinc/13/98/66/1045139866.db2.gz COLZBRFAMGTBBH-KRWDZBQOSA-N 0 3 316.788 4.415 20 5 DIBDHN CCc1cnccc1[C@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000579270049 1045303382 /nfs/dbraw/zinc/30/33/82/1045303382.db2.gz MNHQMGFDULUJIG-KGLIPLIRSA-N 0 3 313.401 4.272 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cs1 ZINC000475672379 1045727051 /nfs/dbraw/zinc/72/70/51/1045727051.db2.gz SKQQUSNYDBOIGE-MQMHXKEQSA-N 0 3 322.817 4.346 20 5 DIBDHN CN(CCc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801517932 1045729626 /nfs/dbraw/zinc/72/96/26/1045729626.db2.gz YCIIQVYJAVXOBB-UHFFFAOYSA-N 0 3 322.767 4.062 20 5 DIBDHN C[C@@]1(NCc2ccc([N+](=O)[O-])c(F)c2)CCCc2ccccc21 ZINC000801523280 1045730292 /nfs/dbraw/zinc/73/02/92/1045730292.db2.gz NUZDLFWERMMDGP-GOSISDBHSA-N 0 3 314.360 4.075 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H](c2cccs2)C2CC2)cc1F ZINC000801527927 1045731182 /nfs/dbraw/zinc/73/11/82/1045731182.db2.gz OORXIUJQJFLQAL-OAHLLOKOSA-N 0 3 306.362 4.036 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H](CC2CC2)c2ccccc2)cc1F ZINC000801531682 1045733357 /nfs/dbraw/zinc/73/33/57/1045733357.db2.gz SOYSLDANIAOXCP-KRWDZBQOSA-N 0 3 314.360 4.365 20 5 DIBDHN CCCN(Cc1ccc(F)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000520173403 1045862370 /nfs/dbraw/zinc/86/23/70/1045862370.db2.gz IZYJSCKGMBPXOI-UHFFFAOYSA-N 0 3 302.349 4.146 20 5 DIBDHN COc1cc([C@H](C)N[C@H](C)c2ccc(C)s2)cc([N+](=O)[O-])c1 ZINC000903076539 1046157676 /nfs/dbraw/zinc/15/76/76/1046157676.db2.gz RRSJKRNAMFXWKP-NWDGAFQWSA-N 0 3 320.414 4.385 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H](c2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000903427634 1046276674 /nfs/dbraw/zinc/27/66/74/1046276674.db2.gz IAVIBHDZAOEWHC-UGSOOPFHSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1c(CN[C@H](c2cccs2)C2CC2)cccc1[N+](=O)[O-] ZINC000224106138 1046424135 /nfs/dbraw/zinc/42/41/35/1046424135.db2.gz IAWYXBUYBWUBNK-INIZCTEOSA-N 0 3 302.399 4.206 20 5 DIBDHN Cc1nc([C@@H](C)NC[C@@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000897466213 1046439710 /nfs/dbraw/zinc/43/97/10/1046439710.db2.gz PUFDJYAAYATYFD-GHMZBOCLSA-N 0 3 319.430 4.122 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000782656087 1046539762 /nfs/dbraw/zinc/53/97/62/1046539762.db2.gz PGEZYOYVVPIYOE-NSHDSACASA-N 0 3 324.730 4.315 20 5 DIBDHN Cc1cc([C@H](C)NC/C=C\c2ccccc2[N+](=O)[O-])c(C)o1 ZINC001116474640 1047146712 /nfs/dbraw/zinc/14/67/12/1047146712.db2.gz HCNVNUMLUGMAEL-WOLRVDTOSA-N 0 3 300.358 4.169 20 5 DIBDHN C[C@H](N[C@@H]1C[C@@H](OC(C)(C)C)C1(C)C)c1ccccc1[N+](=O)[O-] ZINC001183651447 1047951772 /nfs/dbraw/zinc/95/17/72/1047951772.db2.gz DTXMYANKQWHEQO-APHBMKBZSA-N 0 3 320.433 4.228 20 5 DIBDHN CC(C)=CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000480299133 1048114588 /nfs/dbraw/zinc/11/45/88/1048114588.db2.gz AWKMJJIMFINFBA-UHFFFAOYSA-N 0 3 317.414 4.164 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN1CC[C@@]1(C)C1CCCCC1 ZINC001175643703 1048389461 /nfs/dbraw/zinc/38/94/61/1048389461.db2.gz ZFZGFOIHHYSCNO-SFHVURJKSA-N 0 3 318.417 4.148 20 5 DIBDHN C[C@H](N[C@H]1CCCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1 ZINC000159544220 1048570549 /nfs/dbraw/zinc/57/05/49/1048570549.db2.gz GAGKLFBKDPIAAC-SGTLLEGYSA-N 0 3 314.360 4.462 20 5 DIBDHN CCOc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000850312174 1048632795 /nfs/dbraw/zinc/63/27/95/1048632795.db2.gz BSBXBAYVOHGNIM-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1c(Cl)cccc1CN[C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC001203658644 1048951023 /nfs/dbraw/zinc/95/10/23/1048951023.db2.gz QGBFRJLSOWUDML-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@@H](C)C1(C)CC1 ZINC001191454647 1048954990 /nfs/dbraw/zinc/95/49/90/1048954990.db2.gz OXEIRVINAZWUBC-ZDUSSCGKSA-N 0 3 306.406 4.002 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@H](C)C1(C)CC1 ZINC001191454634 1048955526 /nfs/dbraw/zinc/95/55/26/1048955526.db2.gz OXEIRVINAZWUBC-CYBMUJFWSA-N 0 3 306.406 4.002 20 5 DIBDHN CC[C@H](C)CN(CC)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001179980510 1049244661 /nfs/dbraw/zinc/24/46/61/1049244661.db2.gz QXYDNLCRLQENKM-NSHDSACASA-N 0 3 318.339 4.482 20 5 DIBDHN CC(C)[C@@H](C)N(C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001180165802 1049305147 /nfs/dbraw/zinc/30/51/47/1049305147.db2.gz JTXQNZZKDKHZBH-SECBINFHSA-N 0 3 305.205 4.378 20 5 DIBDHN Cc1ccsc1CN(C)[C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485738918 1049329993 /nfs/dbraw/zinc/32/99/93/1049329993.db2.gz PSPBKJZJQRIMRZ-ZDUSSCGKSA-N 0 3 304.415 4.466 20 5 DIBDHN Cc1c(CN2CCC(c3ccsc3)CC2)cccc1[N+](=O)[O-] ZINC000485985034 1049373064 /nfs/dbraw/zinc/37/30/64/1049373064.db2.gz BCZXCVMNVFPYSI-UHFFFAOYSA-N 0 3 316.426 4.344 20 5 DIBDHN CCCC[C@H](C)N(C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001194873997 1049440374 /nfs/dbraw/zinc/44/03/74/1049440374.db2.gz NLQUJVOMAMSJGV-AWEZNQCLSA-N 0 3 308.422 4.393 20 5 DIBDHN CC1(C)CCC[C@H]1[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195429018 1049531417 /nfs/dbraw/zinc/53/14/17/1049531417.db2.gz ZDAJUEJCEWKXAD-BBRMVZONSA-N 0 3 320.408 4.382 20 5 DIBDHN CN(CCc1ccccc1[N+](=O)[O-])Cc1cc(F)cc(Cl)c1 ZINC001205754992 1049553686 /nfs/dbraw/zinc/55/36/86/1049553686.db2.gz AVRZIEXMTOIUKP-UHFFFAOYSA-N 0 3 322.767 4.062 20 5 DIBDHN CC[C@H]1CCCC[C@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001206055737 1049642758 /nfs/dbraw/zinc/64/27/58/1049642758.db2.gz MBSRRLLURPRULW-STQMWFEESA-N 0 3 317.389 4.042 20 5 DIBDHN C[C@@]1(C2CCCCC2)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC001197240043 1049731319 /nfs/dbraw/zinc/73/13/19/1049731319.db2.gz RYWODKGFISSZFN-KRWDZBQOSA-N 0 3 306.381 4.279 20 5 DIBDHN COc1ccc(CN(C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000489157240 1049732044 /nfs/dbraw/zinc/73/20/44/1049732044.db2.gz NTWFQVCNHZTUNU-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@]2(CC2(F)F)C1 ZINC000844441399 1050426327 /nfs/dbraw/zinc/42/63/27/1050426327.db2.gz MRLKCSHFHJGCIJ-DOMZBBRYSA-N 0 3 310.344 4.085 20 5 DIBDHN CC(C)(CNCc1ccc(Cl)cc1[N+](=O)[O-])C(C)(F)F ZINC000829235672 1050506554 /nfs/dbraw/zinc/50/65/54/1050506554.db2.gz CPIITLPAVCXMDF-UHFFFAOYSA-N 0 3 306.740 4.019 20 5 DIBDHN CCOc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000594927143 1050565441 /nfs/dbraw/zinc/56/54/41/1050565441.db2.gz YHMMNEUPORHROT-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN COc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1C ZINC000595106279 1050607394 /nfs/dbraw/zinc/60/73/94/1050607394.db2.gz RRKHSEGKMMIVGL-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN C[C@@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788496696 1050692499 /nfs/dbraw/zinc/69/24/99/1050692499.db2.gz AOKNYUFQOQIGKT-GHMZBOCLSA-N 0 3 319.792 4.242 20 5 DIBDHN CCN(Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@@H](C)C(C)C ZINC000742549868 1050885340 /nfs/dbraw/zinc/88/53/40/1050885340.db2.gz FZAYOKQMMPAZNI-NSHDSACASA-N 0 3 323.418 4.196 20 5 DIBDHN CN(Cc1ccc([N+](=O)[O-])c(F)c1)C(C)(C)c1ccccc1 ZINC000792924322 1051229421 /nfs/dbraw/zinc/22/94/21/1051229421.db2.gz IKAORFUPYNPSBS-UHFFFAOYSA-N 0 3 302.349 4.101 20 5 DIBDHN CCOc1cc(CN2CCC(C3CCC3)CC2)ccc1[N+](=O)[O-] ZINC001171841583 1051230101 /nfs/dbraw/zinc/23/01/01/1051230101.db2.gz QDQRYRGMJIMMTH-UHFFFAOYSA-N 0 3 318.417 4.006 20 5 DIBDHN C[C@@H](N[C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1c(Cl)cccc1Cl ZINC001168988366 1051491458 /nfs/dbraw/zinc/49/14/58/1051491458.db2.gz RHJBAVQIVYUDDS-GMTAPVOTSA-N 0 3 317.216 4.089 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000193900903 1052510932 /nfs/dbraw/zinc/51/09/32/1052510932.db2.gz ZHSOPGIUEYCQEK-STQMWFEESA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@@H]1CCN(Cc2cc(F)ccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000917053300 1052683802 /nfs/dbraw/zinc/68/38/02/1052683802.db2.gz ZQGBXLLNFLWDNH-PVUWLOKVSA-N 0 3 306.381 4.135 20 5 DIBDHN CC(C)N(Cc1ccc(F)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350571 1052977401 /nfs/dbraw/zinc/97/74/01/1052977401.db2.gz MTPOTFMBBQDIHI-UHFFFAOYSA-N 0 3 302.349 4.145 20 5 DIBDHN CC(C)[C@@H](C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610089331 1053007717 /nfs/dbraw/zinc/00/77/17/1053007717.db2.gz NJKDIQQYCQEEET-LBPRGKRZSA-N 0 3 319.430 4.100 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc2c(c1)CCC2 ZINC001319783595 1053273385 /nfs/dbraw/zinc/27/33/85/1053273385.db2.gz HEHXTUSOWJILJC-CQSZACIVSA-N 0 3 310.397 4.243 20 5 DIBDHN Cc1ccncc1[C@@H](C)N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571382 1053325998 /nfs/dbraw/zinc/32/59/98/1053325998.db2.gz HEQSBXAURNXGSZ-FZKQIMNGSA-N 0 3 311.385 4.026 20 5 DIBDHN CC1(NCc2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)CC1 ZINC001321937612 1053442149 /nfs/dbraw/zinc/44/21/49/1053442149.db2.gz PZYVQJHQQUFVJI-UHFFFAOYSA-N 0 3 306.749 4.150 20 5 DIBDHN CC1(F)CCN(Cc2ccc3ccc4cccnc4c3n2)CC1 ZINC001232219053 1053993815 /nfs/dbraw/zinc/99/38/15/1053993815.db2.gz PVFBEALSFCMBDT-UHFFFAOYSA-N 0 3 309.388 4.107 20 5 DIBDHN CCN(Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)C ZINC001344074734 1054463892 /nfs/dbraw/zinc/46/38/92/1054463892.db2.gz IWUHKPIDFMUPLM-UHFFFAOYSA-N 0 3 319.430 4.339 20 5 DIBDHN CCOc1cccc([C@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000131459566 1055741926 /nfs/dbraw/zinc/74/19/26/1055741926.db2.gz SEPPYNXXVBQEHC-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1cc(C)c(CNCc2c(C)ccc([N+](=O)[O-])c2C)c(C)c1 ZINC001620752140 1055925178 /nfs/dbraw/zinc/92/51/78/1055925178.db2.gz WUSQXWQVRGJRHJ-UHFFFAOYSA-N 0 3 312.413 4.427 20 5 DIBDHN Cc1ccc(CNCc2c(C)cc(Cl)cc2C)cc1[N+](=O)[O-] ZINC001621036991 1055997872 /nfs/dbraw/zinc/99/78/72/1055997872.db2.gz WOZOBMAXYZIINL-UHFFFAOYSA-N 0 3 318.804 4.463 20 5 DIBDHN CCN(CC)[C@@H](CNc1cc(C)sc1[N+](=O)[O-])c1ccco1 ZINC001611886498 1056204408 /nfs/dbraw/zinc/20/44/08/1056204408.db2.gz OHPRVAWKDCMEGO-ZDUSSCGKSA-N 0 3 323.418 4.053 20 5 DIBDHN CC[C@@H](C)N[C@H](CNc1cc(C)sc1[N+](=O)[O-])c1ccco1 ZINC001612367584 1056279334 /nfs/dbraw/zinc/27/93/34/1056279334.db2.gz HHLXIUBPNLQGOU-ZWNOBZJWSA-N 0 3 323.418 4.099 20 5 DIBDHN Cc1cc(F)c(CNC[C@@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC001621086662 1056415093 /nfs/dbraw/zinc/41/50/93/1056415093.db2.gz LQNNWFNIIXGMAR-GFCCVEGCSA-N 0 3 320.339 4.075 20 5 DIBDHN CCOc1ccc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000078995830 1056900735 /nfs/dbraw/zinc/90/07/35/1056900735.db2.gz XXRGGTYLRNRFAR-KGLIPLIRSA-N 0 3 314.385 4.405 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000316746154 1056989003 /nfs/dbraw/zinc/98/90/03/1056989003.db2.gz PVJIOKVQPOEAOB-CHWSQXEVSA-N 0 3 300.358 4.015 20 5 DIBDHN Cc1ccc([C@@H](C)NCC2=Cc3ccccc3OC2)cc1[N+](=O)[O-] ZINC000175054561 1057379847 /nfs/dbraw/zinc/37/98/47/1057379847.db2.gz FMXCASRLYURUJQ-CQSZACIVSA-N 0 3 324.380 4.030 20 5 DIBDHN c1ccc2c(c1)cc(-c1noc([C@@H]3CCCN3)n1)c1ccccc21 ZINC001247497493 1059503173 /nfs/dbraw/zinc/50/31/73/1059503173.db2.gz KEPWQMBOWLIURF-SFHVURJKSA-N 0 3 315.376 4.468 20 5 DIBDHN CC[C@@H](NCc1ccc2ncccc2c1)c1cccc([N+](=O)[O-])c1 ZINC001559703784 1059532016 /nfs/dbraw/zinc/53/20/16/1059532016.db2.gz OYDPNNLOEMSDEL-GOSISDBHSA-N 0 3 321.380 4.384 20 5 DIBDHN Cc1c(CN2CCC=C(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC001559824943 1059658989 /nfs/dbraw/zinc/65/89/89/1059658989.db2.gz ANSAQEJFNPKCKH-UHFFFAOYSA-N 0 3 308.381 4.193 20 5 DIBDHN O=[N+]([O-])c1ccc(F)cc1CN1CCCC[C@@H]1CC1CCC1 ZINC001560017359 1059822181 /nfs/dbraw/zinc/82/21/81/1059822181.db2.gz HKHSTNCRRLQEOO-MRXNPFEDSA-N 0 3 306.381 4.279 20 5 DIBDHN O=[N+]([O-])c1ccc(F)cc1CN1CCCC[C@H]1CC1CCC1 ZINC001560017358 1059823431 /nfs/dbraw/zinc/82/34/31/1059823431.db2.gz HKHSTNCRRLQEOO-INIZCTEOSA-N 0 3 306.381 4.279 20 5 DIBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1C[C@H]1C1CCCCC1 ZINC001560359199 1060145173 /nfs/dbraw/zinc/14/51/73/1060145173.db2.gz FEKGEMHQJCCZNQ-DLBZAZTESA-N 0 3 318.417 4.052 20 5 DIBDHN O=[N+]([O-])c1cccc(CN2C[C@H]3CCCC[C@@]32c2ccccc2)c1 ZINC001473229544 1061009327 /nfs/dbraw/zinc/00/93/27/1061009327.db2.gz ANCYWTJFJDJUPM-UYAOXDASSA-N 0 3 322.408 4.496 20 5 DIBDHN COc1ccc(CN2CCCC[C@@H]2CCC(C)C)cc1[N+](=O)[O-] ZINC001473253484 1061030821 /nfs/dbraw/zinc/03/08/21/1061030821.db2.gz NXJAIOYMZLTDCL-MRXNPFEDSA-N 0 3 320.433 4.394 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC=C(c2ccccc2)C1 ZINC001473464668 1061175377 /nfs/dbraw/zinc/17/53/77/1061175377.db2.gz LYKOXXBQJCDZEY-HNNXBMFYSA-N 0 3 308.381 4.445 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1CC1CCC1 ZINC001473663685 1061325435 /nfs/dbraw/zinc/32/54/35/1061325435.db2.gz MELJNANPEAJAHE-MRXNPFEDSA-N 0 3 318.417 4.148 20 5 DIBDHN C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1csc([N+](=O)[O-])c1 ZINC001473818832 1061422842 /nfs/dbraw/zinc/42/28/42/1061422842.db2.gz XGDJNHHLSQXEES-BBRMVZONSA-N 0 3 316.426 4.424 20 5 DIBDHN CCC[C@H]1CCCN1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001473857861 1061437211 /nfs/dbraw/zinc/43/72/11/1061437211.db2.gz DWIVDBRNWBHEKP-HNNXBMFYSA-N 0 3 315.373 4.014 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@H](C)c1cccc(F)c1F ZINC001254545859 1062169710 /nfs/dbraw/zinc/16/97/10/1062169710.db2.gz QAYSWJNUPWJANP-VXGBXAGGSA-N 0 3 320.339 4.155 20 5 DIBDHN C[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001459512244 1062176893 /nfs/dbraw/zinc/17/68/93/1062176893.db2.gz FOGRVPBCFBZLGK-ZLDLUXBVSA-N 0 3 308.809 4.401 20 5 DIBDHN C[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001459512234 1062177534 /nfs/dbraw/zinc/17/75/34/1062177534.db2.gz FOGRVPBCFBZLGK-KYOSRNDESA-N 0 3 308.809 4.401 20 5 DIBDHN C[C@@H](c1ccccc1[N+](=O)[O-])N1CCSC2(CCCCC2)C1 ZINC001459627449 1062263252 /nfs/dbraw/zinc/26/32/52/1062263252.db2.gz CVBQFAYEFRPULL-AWEZNQCLSA-N 0 3 320.458 4.408 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2cccc3ncccc23)cc1[N+](=O)[O-] ZINC001459825082 1062429004 /nfs/dbraw/zinc/42/90/04/1062429004.db2.gz OFXRZJYCQZYFLG-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CC[C@@H](NCc1cc(F)ccc1C)c1cccc([N+](=O)[O-])c1 ZINC001459863465 1062458231 /nfs/dbraw/zinc/45/82/31/1062458231.db2.gz HPJXZOLLHRZDMO-QGZVFWFLSA-N 0 3 302.349 4.283 20 5 DIBDHN CC1(C)CCN(Cc2ccc([N+](=O)[O-])cc2F)CC(C)(C)C1 ZINC001460391192 1062828718 /nfs/dbraw/zinc/82/87/18/1062828718.db2.gz OQIULPDLZCBOHK-UHFFFAOYSA-N 0 3 308.397 4.382 20 5 DIBDHN COc1ccc(CN2CCC[C@@H](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC001460675176 1062978748 /nfs/dbraw/zinc/97/87/48/1062978748.db2.gz VYTGOFJIGFBTFA-MRXNPFEDSA-N 0 3 318.417 4.006 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[C@@H](C)C[C@@H](C)C1 ZINC001460802255 1063067830 /nfs/dbraw/zinc/06/78/30/1063067830.db2.gz PHVAPBVMYYODSF-HUUCEWRRSA-N 0 3 320.433 4.250 20 5 DIBDHN C[C@@H](NCc1cc2ccncc2s1)c1cccc([N+](=O)[O-])c1 ZINC001461063573 1063229528 /nfs/dbraw/zinc/22/95/28/1063229528.db2.gz IIZIWFCJQVCSNU-LLVKDONJSA-N 0 3 313.382 4.055 20 5 DIBDHN C[C@H](CN(C)Cc1ccccc1[N+](=O)[O-])c1cc(F)cc(F)c1 ZINC001461892068 1063779794 /nfs/dbraw/zinc/77/97/94/1063779794.db2.gz LDMZIQMEYSECDE-GFCCVEGCSA-N 0 3 320.339 4.109 20 5 DIBDHN C[C@H](N[C@@H]1CS[C@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000488442121 1063906102 /nfs/dbraw/zinc/90/61/02/1063906102.db2.gz MKKVRROJAXHFKK-HUBLWGQQSA-N 0 3 308.447 4.166 20 5 DIBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(CCCC(F)(F)F)C2)cc1 ZINC001262366625 1063965260 /nfs/dbraw/zinc/96/52/60/1063965260.db2.gz OUSBGNOYZGHROQ-CYBMUJFWSA-N 0 3 316.323 4.117 20 5 DIBDHN Cc1ccccc1CN(Cc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC001307435140 1065397218 /nfs/dbraw/zinc/39/72/18/1065397218.db2.gz IVYKTOZIXUSUOA-UHFFFAOYSA-N 0 3 310.397 4.376 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN(C)C1CCC(C)(C)CC1 ZINC001307531279 1065467403 /nfs/dbraw/zinc/46/74/03/1065467403.db2.gz UTXCMHOADKMKBQ-UHFFFAOYSA-N 0 3 306.406 4.004 20 5 DIBDHN CCCCC[C@@H]1CCCN1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC001307580130 1065494131 /nfs/dbraw/zinc/49/41/31/1065494131.db2.gz AZTKBCQLAFFXDV-OAHLLOKOSA-N 0 3 306.406 4.148 20 5 DIBDHN C[C@H]1CC(C)(C)CC[C@H]1NCc1c(F)cc([N+](=O)[O-])cc1F ZINC001307704626 1065575118 /nfs/dbraw/zinc/57/51/18/1065575118.db2.gz DKYQOMAVLVENCP-ZUZCIYMTSA-N 0 3 312.360 4.177 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1[C@H](C)CCC1(C)C ZINC001307834560 1065645424 /nfs/dbraw/zinc/64/54/24/1065645424.db2.gz MCSJXRLXMREQPT-CYBMUJFWSA-N 0 3 306.406 4.145 20 5 DIBDHN C[C@H](NCc1ccc2c(c1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC001308520819 1066041642 /nfs/dbraw/zinc/04/16/42/1066041642.db2.gz ICISMIOFILBRPO-AWEZNQCLSA-N 0 3 310.397 4.324 20 5 DIBDHN Cc1ccc(F)c(CCNCc2ccc([N+](=O)[O-])cc2Cl)c1 ZINC001308769179 1066243421 /nfs/dbraw/zinc/24/34/21/1066243421.db2.gz XGXJFJSKHWMVSQ-UHFFFAOYSA-N 0 3 322.767 4.028 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000273115075 130090842 /nfs/dbraw/zinc/09/08/42/130090842.db2.gz XDVNXAOMOJGOBS-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1cc(NCC2CCSCC2)c2cc([N+](=O)[O-])ccc2n1 ZINC000317506114 331829397 /nfs/dbraw/zinc/82/93/97/331829397.db2.gz VUWPJHWTDBSXJD-UHFFFAOYSA-N 0 3 317.414 4.007 20 5 DIBDHN CCOc1cccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000126104886 331992838 /nfs/dbraw/zinc/99/28/38/331992838.db2.gz WWXVOPDBOROISE-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN CCN(C/C=C/c1ccccc1[N+](=O)[O-])[C@@H](C)c1cccnc1 ZINC000518507862 332070424 /nfs/dbraw/zinc/07/04/24/332070424.db2.gz LTHVZCLPAPGBCJ-VSGCLNPGSA-N 0 3 311.385 4.086 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CCC[C@@H]2F)s1 ZINC000559359082 332127940 /nfs/dbraw/zinc/12/79/40/332127940.db2.gz ODXNDJZLHVQGMV-UONOGXRCSA-N 0 3 320.389 4.304 20 5 DIBDHN CS[C@H](C)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180996925 332172830 /nfs/dbraw/zinc/17/28/30/332172830.db2.gz ISFRQTICVBYSRE-DYVFJYSZSA-N 0 3 316.426 4.025 20 5 DIBDHN CS[C@H](C)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180996963 332172970 /nfs/dbraw/zinc/17/29/70/332172970.db2.gz ISFRQTICVBYSRE-CXAGYDPISA-N 0 3 316.426 4.025 20 5 DIBDHN Cc1ccc(CNCc2ccc3sccc3c2)cc1[N+](=O)[O-] ZINC000564407107 332317885 /nfs/dbraw/zinc/31/78/85/332317885.db2.gz SUTJQOJHPPTVGL-UHFFFAOYSA-N 0 3 312.394 4.408 20 5 DIBDHN Cc1c(CN[C@H]2CCSc3ccccc32)cccc1[N+](=O)[O-] ZINC000319174607 333269282 /nfs/dbraw/zinc/26/92/82/333269282.db2.gz JJYRXSMSNGUFFX-HNNXBMFYSA-N 0 3 314.410 4.230 20 5 DIBDHN C[C@H]1[C@H](c2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000531202366 333330809 /nfs/dbraw/zinc/33/08/09/333330809.db2.gz ULQRNEXDGQSTCL-SWLSCSKDSA-N 0 3 302.399 4.034 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000062726408 333336229 /nfs/dbraw/zinc/33/62/29/333336229.db2.gz UTXNVYDHCLHZGC-JTQLQIEISA-N 0 3 310.806 4.203 20 5 DIBDHN CC(C)c1ccc(CN[C@@H]2CCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000531758692 333553931 /nfs/dbraw/zinc/55/39/31/333553931.db2.gz BJEXPKISHUARJC-CYBMUJFWSA-N 0 3 312.360 4.386 20 5 DIBDHN C[C@@H](N[C@H](C)[C@@H]1C[C@H]1c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000417311869 334705031 /nfs/dbraw/zinc/70/50/31/334705031.db2.gz QMFBLDFUASQTBS-RJZRQDKASA-N 0 3 316.426 4.499 20 5 DIBDHN COc1ccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000537964070 335311508 /nfs/dbraw/zinc/31/15/08/335311508.db2.gz DWCHPKZSFNFGLU-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN CCC[C@@H](NCCc1ccc(C)o1)c1cccc([N+](=O)[O-])c1 ZINC000532197926 335914588 /nfs/dbraw/zinc/91/45/88/335914588.db2.gz DQILBYUEIGMJSH-QGZVFWFLSA-N 0 3 302.374 4.170 20 5 DIBDHN CSc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC000389431106 336390524 /nfs/dbraw/zinc/39/05/24/336390524.db2.gz ULGQXIIRXQPBSL-CYBMUJFWSA-N 0 3 316.426 4.476 20 5 DIBDHN CCc1cnccc1[C@H](C)N[C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000359315262 336667294 /nfs/dbraw/zinc/66/72/94/336667294.db2.gz SFGHROWYKKYOHH-UGSOOPFHSA-N 0 3 313.401 4.354 20 5 DIBDHN Cc1cccc2c1OCC[C@H]2NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000188872619 337275933 /nfs/dbraw/zinc/27/59/33/337275933.db2.gz ZGYZRUUUAZVCOY-ZGRWHYIRSA-N 0 3 324.380 4.030 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1cccc(Cl)c1 ZINC000572303008 337605528 /nfs/dbraw/zinc/60/55/28/337605528.db2.gz WMYXRYKCJQNSAX-HNNXBMFYSA-N 0 3 302.761 4.025 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC34CC4)o2)c(Cl)c1 ZINC000424186332 337802050 /nfs/dbraw/zinc/80/20/50/337802050.db2.gz RWTRMVKUDSCLIT-HNNXBMFYSA-N 0 3 318.760 4.150 20 5 DIBDHN C[C@H]1C[C@H]1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000537246294 337927356 /nfs/dbraw/zinc/92/73/56/337927356.db2.gz HUEYZBHPZHSRRS-QWRGUYRKSA-N 0 3 320.776 4.254 20 5 DIBDHN CN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccc2[nH]ccc21 ZINC000426389013 338030103 /nfs/dbraw/zinc/03/01/03/338030103.db2.gz JTJMPGQIMXETDI-VMPITWQZSA-N 0 3 321.380 4.221 20 5 DIBDHN C[C@@H]1CCCC[C@@H]1OCCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429262111 338075212 /nfs/dbraw/zinc/07/52/12/338075212.db2.gz DJXZQCAEOZAOBU-PBHICJAKSA-N 0 3 320.433 4.015 20 5 DIBDHN CC[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000152800602 338212171 /nfs/dbraw/zinc/21/21/71/338212171.db2.gz MPGHTIQUNCECKW-UGSOOPFHSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1cc2c(s1)CCCC2 ZINC000153357588 338223133 /nfs/dbraw/zinc/22/31/33/338223133.db2.gz UKGJMNCEXVIHTM-LBPRGKRZSA-N 0 3 316.426 4.386 20 5 DIBDHN Cc1ccc(CN[C@H]2C[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000435782705 338248921 /nfs/dbraw/zinc/24/89/21/338248921.db2.gz SAGPMTMSNZPLET-SHTZXODSSA-N 0 3 314.360 4.078 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000437113339 338301590 /nfs/dbraw/zinc/30/15/90/338301590.db2.gz WRGKMDXPGFNTFQ-GWCFXTLKSA-N 0 3 304.312 4.222 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@@H]2CC[C@@H](Cc3ccccc3)C2)cs1 ZINC000438355198 338341036 /nfs/dbraw/zinc/34/10/36/338341036.db2.gz RSGIHGFDIMIMFG-GOEBONIOSA-N 0 3 316.426 4.157 20 5 DIBDHN Cc1ccc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000447545746 338556112 /nfs/dbraw/zinc/55/61/12/338556112.db2.gz ZCHADHIMRLGPQA-IBGZPJMESA-N 0 3 310.397 4.379 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC2CC(c3ccccc3)C2)c(Cl)c1 ZINC000466420827 339203860 /nfs/dbraw/zinc/20/38/60/339203860.db2.gz HDMNPQANLVHGSZ-UHFFFAOYSA-N 0 3 316.788 4.284 20 5 DIBDHN C[C@H](NC[C@H]1CCC2(CCCCC2)O1)c1ccccc1[N+](=O)[O-] ZINC000467189508 339227506 /nfs/dbraw/zinc/22/75/06/339227506.db2.gz DXQSCENFCKTLGW-LSDHHAIUSA-N 0 3 318.417 4.127 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000468006466 339251002 /nfs/dbraw/zinc/25/10/02/339251002.db2.gz RMMQBRUMHFKQBL-NSHDSACASA-N 0 3 322.767 4.281 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CNC/C=C\c1ccccc1 ZINC000468593729 339266937 /nfs/dbraw/zinc/26/69/37/339266937.db2.gz BNYKNTYAWAAETP-NZSUIAPYSA-N 0 3 308.381 4.301 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNC/C=C\c1ccccc1 ZINC000468593731 339266969 /nfs/dbraw/zinc/26/69/69/339266969.db2.gz BNYKNTYAWAAETP-RSZNUKOESA-N 0 3 308.381 4.301 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000475328477 339446688 /nfs/dbraw/zinc/44/66/88/339446688.db2.gz BUODRHRIDSJGRI-PBHICJAKSA-N 0 3 314.360 4.160 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H]2CCCO[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000480724530 339584819 /nfs/dbraw/zinc/58/48/19/339584819.db2.gz VSXSDDQQIDONKP-QILLFSRXSA-N 0 3 320.433 4.148 20 5 DIBDHN O=[N+]([O-])c1cccc([C@@H](N[C@@H]2CC=CCC2)c2ccccc2)c1 ZINC000494039521 339939606 /nfs/dbraw/zinc/93/96/06/339939606.db2.gz PHYJACDVUSSVRG-MJGOQNOKSA-N 0 3 308.381 4.383 20 5 DIBDHN C[C@@H](NCCSC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000501016267 340072383 /nfs/dbraw/zinc/07/23/83/340072383.db2.gz UEKOVKKJAHBUBR-CYBMUJFWSA-N 0 3 308.447 4.311 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN1CCC[C@H]1C1CCCCC1 ZINC000505853219 340179763 /nfs/dbraw/zinc/17/97/63/340179763.db2.gz IVMRGACNGCGQAI-INIZCTEOSA-N 0 3 306.381 4.279 20 5 DIBDHN COc1ccc([C@H](C)N(C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000506324781 340192273 /nfs/dbraw/zinc/19/22/73/340192273.db2.gz GMDGYVMTHGVCEJ-AWEZNQCLSA-N 0 3 314.385 4.105 20 5 DIBDHN COc1ccc([C@@H](C)N(C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000506324782 340192349 /nfs/dbraw/zinc/19/23/49/340192349.db2.gz GMDGYVMTHGVCEJ-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(C2CC2)[C@@H]2CCc3ccccc32)cc1 ZINC000510665840 340305637 /nfs/dbraw/zinc/30/56/37/340305637.db2.gz RZWISLQCUBTDCZ-LJQANCHMSA-N 0 3 308.381 4.247 20 5 DIBDHN CCN(CC)[C@H](CNc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000513194039 340396346 /nfs/dbraw/zinc/39/63/46/340396346.db2.gz LCDWYHUDADCLHC-MRXNPFEDSA-N 0 3 319.430 4.151 20 5 DIBDHN CC[C@H](N[C@H]1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC000513858277 340428791 /nfs/dbraw/zinc/42/87/91/340428791.db2.gz XBUSEECRZANIJV-ROUUACIJSA-N 0 3 314.360 4.462 20 5 DIBDHN CC1(C)CC[C@H](NCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000236749595 340664600 /nfs/dbraw/zinc/66/46/00/340664600.db2.gz JCCFNMWYXBOPCP-SFHVURJKSA-N 0 3 310.397 4.497 20 5 DIBDHN Cc1c(CNCc2ccc(C(F)(F)F)cc2)cccc1[N+](=O)[O-] ZINC000237603091 340672630 /nfs/dbraw/zinc/67/26/30/340672630.db2.gz YGALFAPAZFJRJE-UHFFFAOYSA-N 0 3 324.302 4.212 20 5 DIBDHN Cc1ccc2cc(CNCc3cccc([N+](=O)[O-])c3C)ccc2n1 ZINC000326376826 340714461 /nfs/dbraw/zinc/71/44/61/340714461.db2.gz KZUKPEHDIPYBRR-UHFFFAOYSA-N 0 3 321.380 4.050 20 5 DIBDHN Cc1c([C@H](C)N[C@@H]2C[C@@H]2Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000537983333 340795572 /nfs/dbraw/zinc/79/55/72/340795572.db2.gz HEMKVWLIDFHOIQ-QILLFSRXSA-N 0 3 310.397 4.185 20 5 DIBDHN CC[C@@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)(C)C ZINC000538392099 340820280 /nfs/dbraw/zinc/82/02/80/340820280.db2.gz JYKOCTUHBJAJMM-OAHLLOKOSA-N 0 3 317.389 4.164 20 5 DIBDHN COc1cc(CN[C@H](c2ccccc2)C(C)C)ccc1[N+](=O)[O-] ZINC000538703569 340838891 /nfs/dbraw/zinc/83/88/91/340838891.db2.gz QQRCEGKHRLUCBQ-SFHVURJKSA-N 0 3 314.385 4.090 20 5 DIBDHN Cc1cc([C@@H](C)NCCOc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000539365503 340882586 /nfs/dbraw/zinc/88/25/86/340882586.db2.gz XOHZBISNYJXPDU-GFCCVEGCSA-N 0 3 320.414 4.003 20 5 DIBDHN COc1ccc(CN[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000540160866 340919022 /nfs/dbraw/zinc/91/90/22/340919022.db2.gz PHSZPRQLLADOFT-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN CCc1cnccc1[C@H](C)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000540314700 340926420 /nfs/dbraw/zinc/92/64/20/340926420.db2.gz VCCLSYYWVNIWCZ-KGLIPLIRSA-N 0 3 313.401 4.272 20 5 DIBDHN Cc1c(CNC2(c3ccccc3)CCCC2)cccc1[N+](=O)[O-] ZINC000540387766 340929073 /nfs/dbraw/zinc/92/90/73/340929073.db2.gz AUBMIHFJBINHRE-UHFFFAOYSA-N 0 3 310.397 4.462 20 5 DIBDHN Cc1ccc([C@H](NCCc2ccc([N+](=O)[O-])cc2)C2CCC2)o1 ZINC000542668622 341016511 /nfs/dbraw/zinc/01/65/11/341016511.db2.gz OPBQKIVZTDJXJG-GOSISDBHSA-N 0 3 314.385 4.170 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H]1c1ccsc1 ZINC000543632172 341052244 /nfs/dbraw/zinc/05/22/44/341052244.db2.gz VYOGVEMHEPSTTE-MRXNPFEDSA-N 0 3 302.399 4.302 20 5 DIBDHN COc1ccc([C@H](C)N(C)Cc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000544611589 341088991 /nfs/dbraw/zinc/08/89/91/341088991.db2.gz HELDGWGNPWYYPK-AWEZNQCLSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1ccc([C@H](NCCc2cccc([N+](=O)[O-])c2)C2CCC2)o1 ZINC000544614954 341089278 /nfs/dbraw/zinc/08/92/78/341089278.db2.gz VEJFNHVCINEWEA-GOSISDBHSA-N 0 3 314.385 4.170 20 5 DIBDHN CC[C@@H](CC(F)(F)F)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000546165498 341155200 /nfs/dbraw/zinc/15/52/00/341155200.db2.gz HJXKMUQSPRJRNB-MNOVXSKESA-N 0 3 304.312 4.285 20 5 DIBDHN CC[C@H](CC(F)(F)F)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000546165495 341155218 /nfs/dbraw/zinc/15/52/18/341155218.db2.gz HJXKMUQSPRJRNB-GHMZBOCLSA-N 0 3 304.312 4.285 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CCCO[C@H]1CC(C)C ZINC000547831497 341236175 /nfs/dbraw/zinc/23/61/75/341236175.db2.gz LEAAJBLJHPYPLP-WBAXXEDZSA-N 0 3 320.433 4.148 20 5 DIBDHN CCC(C)(C)N(C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549527539 341296438 /nfs/dbraw/zinc/29/64/38/341296438.db2.gz QPSLNSCOVAQTEU-UHFFFAOYSA-N 0 3 304.312 4.234 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@H]2C[C@H](c3ccccc3Cl)C2)cs1 ZINC000549935353 341307410 /nfs/dbraw/zinc/30/74/10/341307410.db2.gz ARGAEZLZDOBWBJ-HAQNSBGRSA-N 0 3 322.817 4.346 20 5 DIBDHN C[C@H](N[C@H]1CCCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000090964130 341420856 /nfs/dbraw/zinc/42/08/56/341420856.db2.gz NZFMMCXMVMHULQ-SGTLLEGYSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CNCc1cc2ccccc2s1 ZINC000555590982 341486240 /nfs/dbraw/zinc/48/62/40/341486240.db2.gz PPEYNGDEMVKQDD-UHFFFAOYSA-N 0 3 312.394 4.408 20 5 DIBDHN Cc1cc([C@H](NCc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000158728004 341663380 /nfs/dbraw/zinc/66/33/80/341663380.db2.gz OYPGBLXGBBJMFT-GOSISDBHSA-N 0 3 314.360 4.283 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1CCN[C@H]1CCCc2occc21 ZINC000577457164 341910572 /nfs/dbraw/zinc/91/05/72/341910572.db2.gz DUFWIINYRYTNHA-AWEZNQCLSA-N 0 3 320.776 4.051 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](NCc1cccs1)CCCC2 ZINC000417328373 518203044 /nfs/dbraw/zinc/20/30/44/518203044.db2.gz SMAKZIJBXBHYDW-INIZCTEOSA-N 0 3 302.399 4.214 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H]1CCCc2sccc21 ZINC000574414477 518203100 /nfs/dbraw/zinc/20/31/00/518203100.db2.gz NHGUQBWDKYXEIR-LSDHHAIUSA-N 0 3 314.410 4.311 20 5 DIBDHN C[C@H](N[C@@H]1CCc2c1cccc2F)c1ccc([N+](=O)[O-])cc1 ZINC000267415616 525583267 /nfs/dbraw/zinc/58/32/67/525583267.db2.gz JCLNFXWXXFQUAA-APPDUMDISA-N 0 3 300.333 4.072 20 5 DIBDHN CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000578566270 1036376379 /nfs/dbraw/zinc/37/63/79/1036376379.db2.gz KCQJDRJVNVDPMF-UHFFFAOYSA-N 0 3 318.751 4.258 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H]1c1cccnc1 ZINC000581396393 1037580297 /nfs/dbraw/zinc/58/02/97/1037580297.db2.gz AECGVEWHEOHYHZ-ILCZHQDMSA-N 0 3 323.396 4.230 20 5 DIBDHN CCC[C@H]1[C@H](C)CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582553 1037642284 /nfs/dbraw/zinc/64/22/84/1037642284.db2.gz XTEIMDQGGIYWLA-DOMZBBRYSA-N 0 3 317.389 4.137 20 5 DIBDHN Cc1c([C@H](C)N[C@@H]2CCc3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000178088324 1037813357 /nfs/dbraw/zinc/81/33/57/1037813357.db2.gz AFRLAJQPUKXCEV-YVEFUNNKSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1c([C@H](C)N[C@H]2CCc3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000178088341 1037814423 /nfs/dbraw/zinc/81/44/23/1037814423.db2.gz AFRLAJQPUKXCEV-SJCJKPOMSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1[nH]c2ccc(CNCc3ccc(C)c([N+](=O)[O-])c3)cc2c1C ZINC000065013576 1038056424 /nfs/dbraw/zinc/05/64/24/1038056424.db2.gz PXOPQWCLCCMMPN-UHFFFAOYSA-N 0 3 323.396 4.291 20 5 DIBDHN CC[C@H](C)[C@H]1CCCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582170 1038203030 /nfs/dbraw/zinc/20/30/30/1038203030.db2.gz FMNRXWVGYZTTOT-SWLSCSKDSA-N 0 3 317.389 4.137 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCC(F)(F)C3)o2)cc1 ZINC000610787754 1038307839 /nfs/dbraw/zinc/30/78/39/1038307839.db2.gz JXIVMZDUTQSQTC-GFCCVEGCSA-N 0 3 322.311 4.132 20 5 DIBDHN CSc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000178591429 1038683484 /nfs/dbraw/zinc/68/34/84/1038683484.db2.gz NWALMDGYZXGANK-CYBMUJFWSA-N 0 3 316.426 4.476 20 5 DIBDHN CCOc1ccc([C@@H](C)NCc2cccc(C)c2)cc1[N+](=O)[O-] ZINC000152702337 1039121201 /nfs/dbraw/zinc/12/12/01/1039121201.db2.gz KTFSKMVHQWBZLV-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN CC(C)(CNCc1ccc([N+](=O)[O-])cc1Cl)C(C)(F)F ZINC000829237920 1039224776 /nfs/dbraw/zinc/22/47/76/1039224776.db2.gz ZZNIOMNWKQNEHW-UHFFFAOYSA-N 0 3 306.740 4.019 20 5 DIBDHN CC[C@@H](N[C@H](C)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000172831654 1040866766 /nfs/dbraw/zinc/86/67/66/1040866766.db2.gz NIIZEYBHDKIYBT-FZKQIMNGSA-N 0 3 314.385 4.405 20 5 DIBDHN CSCc1cccc(CNCc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000189480249 1041306152 /nfs/dbraw/zinc/30/61/52/1041306152.db2.gz VMXDFGMJQLIFGP-UHFFFAOYSA-N 0 3 316.426 4.056 20 5 DIBDHN Cc1cc(F)ccc1[C@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000815566054 1041964050 /nfs/dbraw/zinc/96/40/50/1041964050.db2.gz HPEOIYVHAUVBDP-OLZOCXBDSA-N 0 3 302.349 4.454 20 5 DIBDHN CCC[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC001167957970 1042787793 /nfs/dbraw/zinc/78/77/93/1042787793.db2.gz FZDZLUUKGGHTDR-CQSZACIVSA-N 0 3 306.406 4.006 20 5 DIBDHN CC(C)Oc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178642966 1043134857 /nfs/dbraw/zinc/13/48/57/1043134857.db2.gz YZSZITBMOQNCPE-AWEZNQCLSA-N 0 3 314.385 4.233 20 5 DIBDHN C[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441490044 1043181780 /nfs/dbraw/zinc/18/17/80/1043181780.db2.gz VJVKKZFKJCHAHN-LALPHHSUSA-N 0 3 308.809 4.401 20 5 DIBDHN C[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441490043 1043182238 /nfs/dbraw/zinc/18/22/38/1043182238.db2.gz VJVKKZFKJCHAHN-JMSVASOKSA-N 0 3 308.809 4.401 20 5 DIBDHN CC(C)(CNCc1cc(Cl)ccc1[N+](=O)[O-])C(C)(F)F ZINC000829235469 1043259396 /nfs/dbraw/zinc/25/93/96/1043259396.db2.gz AQRPBUQVFQGYRA-UHFFFAOYSA-N 0 3 306.740 4.019 20 5 DIBDHN Cc1oc2ccccc2c1CNCc1cccc([N+](=O)[O-])c1C ZINC000323045957 1043299924 /nfs/dbraw/zinc/29/99/24/1043299924.db2.gz DUOGGTCPRFALAK-UHFFFAOYSA-N 0 3 310.353 4.248 20 5 DIBDHN COc1cccc([C@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000268803129 1043333242 /nfs/dbraw/zinc/33/32/42/1043333242.db2.gz QUNVVCBXZKHHLH-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@H](NCC[C@]1(C)C[C@@]1(F)Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872084475 1043453412 /nfs/dbraw/zinc/45/34/12/1043453412.db2.gz SJRHBIGUISWFFF-FZZIBODNSA-N 0 3 318.751 4.089 20 5 DIBDHN CC1=C(c2ccco2)CN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000558734619 1043582959 /nfs/dbraw/zinc/58/29/59/1043582959.db2.gz QTMTWYUWSHVTON-AWEZNQCLSA-N 0 3 312.369 4.428 20 5 DIBDHN Cc1cccc2c1OCC[C@H]2NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000353234884 1043593616 /nfs/dbraw/zinc/59/36/16/1043593616.db2.gz ZGYZRUUUAZVCOY-CTEOGUNLSA-N 0 3 324.380 4.030 20 5 DIBDHN Cc1nc([C@H](C)NCCCCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000358208507 1044035458 /nfs/dbraw/zinc/03/54/58/1044035458.db2.gz VICFTWDNNJGNNE-LBPRGKRZSA-N 0 3 319.430 4.033 20 5 DIBDHN CSc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000035256532 1044319925 /nfs/dbraw/zinc/31/99/25/1044319925.db2.gz ICXNPMGCBOLDCF-GFCCVEGCSA-N 0 3 302.399 4.168 20 5 DIBDHN Cc1c(CN[C@@H]2CCc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000565867883 1044460489 /nfs/dbraw/zinc/46/04/89/1044460489.db2.gz OGEGHMNIWKNDDA-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN Cc1ccc2c(c1)[C@@H](NCc1cccc([N+](=O)[O-])c1C)[C@@H](C)C2 ZINC000577442867 1045125537 /nfs/dbraw/zinc/12/55/37/1045125537.db2.gz FWDMQLIGZHZPLW-DJJJIMSYSA-N 0 3 310.397 4.235 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1ccc(Cl)cc1)CCC2 ZINC000447514276 1045139587 /nfs/dbraw/zinc/13/95/87/1045139587.db2.gz COLZBRFAMGTBBH-QGZVFWFLSA-N 0 3 316.788 4.415 20 5 DIBDHN Cc1cc(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)ccc1F ZINC000447539834 1045143298 /nfs/dbraw/zinc/14/32/98/1045143298.db2.gz HTFZQCSSGVVFNK-GOSISDBHSA-N 0 3 314.360 4.210 20 5 DIBDHN CC[C@H](C)N[C@H](CNc1ccc([N+](=O)[O-])c(C)c1)c1ccco1 ZINC000557696737 1045219021 /nfs/dbraw/zinc/21/90/21/1045219021.db2.gz WCKXEDUSKXHZCI-DZGCQCFKSA-N 0 3 317.389 4.038 20 5 DIBDHN C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1Cc1cccc([N+](=O)[O-])c1 ZINC000449365937 1045383055 /nfs/dbraw/zinc/38/30/55/1045383055.db2.gz UUPLXNPGENUUPX-LOWVWBTDSA-N 0 3 316.323 4.146 20 5 DIBDHN Cc1cc([C@@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)ccc1F ZINC000449373660 1045384177 /nfs/dbraw/zinc/38/41/77/1045384177.db2.gz TXZIGHKMZJKBER-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1Cc1ccc([N+](=O)[O-])cc1 ZINC000449357526 1045385228 /nfs/dbraw/zinc/38/52/28/1045385228.db2.gz AWYQLPPOXGLNJR-DMDPSCGWSA-N 0 3 316.323 4.146 20 5 DIBDHN CC[C@@](C)(NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000801529771 1045730221 /nfs/dbraw/zinc/73/02/21/1045730221.db2.gz QFPGGULFGPKYTH-QGZVFWFLSA-N 0 3 302.349 4.149 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H](c2ccccc2)C2CCC2)cc1F ZINC000801523227 1045731609 /nfs/dbraw/zinc/73/16/09/1045731609.db2.gz LVRVRCIZMNIGED-SFHVURJKSA-N 0 3 314.360 4.365 20 5 DIBDHN CCOc1cc(CN[C@@H](C)c2cccc(C)c2)ccc1[N+](=O)[O-] ZINC000452079120 1045769136 /nfs/dbraw/zinc/76/91/36/1045769136.db2.gz FVPBBLNCSXQBLB-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN COc1cc(C)c([C@@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000753675783 1045788291 /nfs/dbraw/zinc/78/82/91/1045788291.db2.gz DOJOMXYFVCGGGK-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN COc1cc(C)c([C@H](C)NCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000753675778 1045789896 /nfs/dbraw/zinc/78/98/96/1045789896.db2.gz DOJOMXYFVCGGGK-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN Cc1csc(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000453314040 1046031556 /nfs/dbraw/zinc/03/15/56/1046031556.db2.gz ICNOUJNGSLVHKG-INIZCTEOSA-N 0 3 302.399 4.132 20 5 DIBDHN CCOc1ccc([C@@H](C)NCc2cc(C)cs2)cc1[N+](=O)[O-] ZINC000453318029 1046033794 /nfs/dbraw/zinc/03/37/94/1046033794.db2.gz MAYGUEYMUYXBRC-GFCCVEGCSA-N 0 3 320.414 4.214 20 5 DIBDHN COc1cc([C@@H](C)N[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000903056593 1046150802 /nfs/dbraw/zinc/15/08/02/1046150802.db2.gz WFJNHOYVAWYIGY-CHWSQXEVSA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@@H](CN[C@@H](C)c1cccnc1Cl)c1ccccc1[N+](=O)[O-] ZINC000903244846 1046207753 /nfs/dbraw/zinc/20/77/53/1046207753.db2.gz FJLTWJUVOTYQHZ-RYUDHWBXSA-N 0 3 319.792 4.098 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000903286624 1046224330 /nfs/dbraw/zinc/22/43/30/1046224330.db2.gz DDYIXTLUVNSQPO-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1ccc([C@H]2CCCN2Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000261441554 1046548207 /nfs/dbraw/zinc/54/82/07/1046548207.db2.gz BSQLTSBCHSAFQW-OAHLLOKOSA-N 0 3 302.399 4.302 20 5 DIBDHN Cc1cccc([C@@H]2CCN(Cc3cc(F)ccc3[N+](=O)[O-])C2)c1 ZINC000784481212 1046691940 /nfs/dbraw/zinc/69/19/40/1046691940.db2.gz LKMZDKLGHDFLOU-OAHLLOKOSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CCCOc1ccccc1 ZINC000302768277 1046802830 /nfs/dbraw/zinc/80/28/30/1046802830.db2.gz XCMJLYNRPNKISA-HNNXBMFYSA-N 0 3 314.385 4.057 20 5 DIBDHN c1ccc2c(c1)cc1ccccc1c2CN1C[C@H]2CC[C@@H](C1)O2 ZINC001141722743 1047276236 /nfs/dbraw/zinc/27/62/36/1047276236.db2.gz HIRFEBXPWZNLOY-HDICACEKSA-N 0 3 303.405 4.356 20 5 DIBDHN CC[C@H]1CC[C@@H](C)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000537853143 1047641821 /nfs/dbraw/zinc/64/18/21/1047641821.db2.gz WFYGAMCVUOUOOJ-DOMZBBRYSA-N 0 3 315.373 4.013 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H](c1cccnc1)C1CC1 ZINC000539051930 1047727367 /nfs/dbraw/zinc/72/73/67/1047727367.db2.gz PULUJLDFHZVBDA-SCLBCKFNSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1c(CN[C@H]2CC(C)(C)c3ccccc32)cccc1[N+](=O)[O-] ZINC000478477218 1047788791 /nfs/dbraw/zinc/78/87/91/1047788791.db2.gz DYKUIOCLWYNNTA-KRWDZBQOSA-N 0 3 310.397 4.415 20 5 DIBDHN Cc1ccc2c(c1)[C@@H](NCc1cccc([N+](=O)[O-])c1C)CCC2 ZINC000478504069 1047790673 /nfs/dbraw/zinc/79/06/73/1047790673.db2.gz VEABZSSYXSVHKM-SFHVURJKSA-N 0 3 310.397 4.379 20 5 DIBDHN Cc1cc2cc3cc(C)c(Nc4cnoc4)cc3nc2cc1N ZINC001203246175 1048099812 /nfs/dbraw/zinc/09/98/12/1048099812.db2.gz AABKWNIPXXPOIV-UHFFFAOYSA-N 0 3 304.353 4.319 20 5 DIBDHN Cc1ccc2[nH]c(CNCc3cccc([N+](=O)[O-])c3C)cc2c1C ZINC000480446492 1048146331 /nfs/dbraw/zinc/14/63/31/1048146331.db2.gz SDZCXOIIACOVHY-UHFFFAOYSA-N 0 3 323.396 4.291 20 5 DIBDHN Cc1ccsc1CN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064993446 1048262024 /nfs/dbraw/zinc/26/20/24/1048262024.db2.gz UFNXEDOPACENNU-UHFFFAOYSA-N 0 3 304.415 4.375 20 5 DIBDHN O=[N+]([O-])c1sccc1NCCN1CCC2(CCCCC2)CC1 ZINC001186248243 1048274677 /nfs/dbraw/zinc/27/46/77/1048274677.db2.gz JGALDGQXYFKRPS-UHFFFAOYSA-N 0 3 323.462 4.115 20 5 DIBDHN C[C@H]1CC(C)(C)CC[C@@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000481086849 1048306847 /nfs/dbraw/zinc/30/68/47/1048306847.db2.gz CWLFOZCTYVZWHX-AAEUAGOBSA-N 0 3 317.389 4.040 20 5 DIBDHN C[C@H](N[C@H]1CCSc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000192834638 1048319346 /nfs/dbraw/zinc/31/93/46/1048319346.db2.gz QTJLAXOFAASFTA-LRDDRELGSA-N 0 3 314.410 4.483 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCCC(F)(F)CC1 ZINC000600187101 1048385307 /nfs/dbraw/zinc/38/53/07/1048385307.db2.gz DJFQKJMIBMDITL-JLHYYAGUSA-N 0 3 310.344 4.119 20 5 DIBDHN Cc1cc2cc3cc(C)c(NC4=CCOCC4)cc3nc2cc1N ZINC001176145559 1048563596 /nfs/dbraw/zinc/56/35/96/1048563596.db2.gz JWZGICFKGZBHFV-UHFFFAOYSA-N 0 3 319.408 4.303 20 5 DIBDHN CC(C)c1ccc(CN2CCSCC[C@H]2C)cc1[N+](=O)[O-] ZINC000483416954 1048791727 /nfs/dbraw/zinc/79/17/27/1048791727.db2.gz HGJUCGFRLUXVOD-CYBMUJFWSA-N 0 3 308.447 4.046 20 5 DIBDHN CC(C)(F)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001203326844 1048870789 /nfs/dbraw/zinc/87/07/89/1048870789.db2.gz HXJVCDQQQZPGKR-UHFFFAOYSA-N 0 3 308.378 4.161 20 5 DIBDHN CCc1ccc(C(C)(C)NCc2cccc([N+](=O)[O-])c2C)cc1 ZINC001192719361 1049136091 /nfs/dbraw/zinc/13/60/91/1049136091.db2.gz MNDRZUVFTTURHZ-UHFFFAOYSA-N 0 3 312.413 4.491 20 5 DIBDHN CCOc1cccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173364235 1049139200 /nfs/dbraw/zinc/13/92/00/1049139200.db2.gz RHTZSIOSHMDZEP-KGLIPLIRSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1ccc(CNCc2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] ZINC001179385843 1049162995 /nfs/dbraw/zinc/16/29/95/1049162995.db2.gz CHZNRNKOPYTPCA-UHFFFAOYSA-N 0 3 310.397 4.072 20 5 DIBDHN C[C@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC001204498093 1049176442 /nfs/dbraw/zinc/17/64/42/1049176442.db2.gz XETNPKTVUUDDOL-NSHDSACASA-N 0 3 316.323 4.236 20 5 DIBDHN Cc1cccc2[nH]c(CN[C@H](C)c3ccc([N+](=O)[O-])cc3)cc21 ZINC001179574890 1049179366 /nfs/dbraw/zinc/17/93/66/1049179366.db2.gz IGGRBHGBCRRBRF-CYBMUJFWSA-N 0 3 309.369 4.235 20 5 DIBDHN CCC(F)(F)C(C)(C)CNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000858270840 1049234089 /nfs/dbraw/zinc/23/40/89/1049234089.db2.gz NYHJVVSGYSWSEM-UHFFFAOYSA-N 0 3 320.767 4.409 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1Cc2ccccc2C[C@H]1C ZINC001180091677 1049264146 /nfs/dbraw/zinc/26/41/46/1049264146.db2.gz DCPQTMSZBCFUNT-AAGJOFLKSA-N 0 3 322.408 4.445 20 5 DIBDHN C[C@@H](N(C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(C)(C)C ZINC001180253204 1049321037 /nfs/dbraw/zinc/32/10/37/1049321037.db2.gz HRQVQAHGOKZYGD-SNVBAGLBSA-N 0 3 318.339 4.480 20 5 DIBDHN CC1(C)CCC[C@@H]1[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001195429021 1049532625 /nfs/dbraw/zinc/53/26/25/1049532625.db2.gz ZDAJUEJCEWKXAD-XJKSGUPXSA-N 0 3 320.408 4.382 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1CN1CCCC2(CCCC2)CC1 ZINC001196047922 1049608777 /nfs/dbraw/zinc/60/87/77/1049608777.db2.gz IDMBOPLBYCBTEU-UHFFFAOYSA-N 0 3 318.417 4.150 20 5 DIBDHN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1(C)CCCC1 ZINC000489874285 1049789387 /nfs/dbraw/zinc/78/93/87/1049789387.db2.gz KRTNMMKHGBXLHV-UHFFFAOYSA-N 0 3 315.373 4.014 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)C[C@H]1CC=CCC1 ZINC001168401222 1050235099 /nfs/dbraw/zinc/23/50/99/1050235099.db2.gz GXYMIXLETVXQTL-HNNXBMFYSA-N 0 3 318.417 4.170 20 5 DIBDHN COc1ccc([N+](=O)[O-])cc1Nc1ccnc(C(C)(C)C)c1 ZINC001210444155 1050246734 /nfs/dbraw/zinc/24/67/34/1050246734.db2.gz DSKGRZGJDWQOCX-UHFFFAOYSA-N 0 3 301.346 4.040 20 5 DIBDHN Cc1c(CN[C@H](CC(C)C)c2ccncc2)cccc1[N+](=O)[O-] ZINC000592389649 1050296894 /nfs/dbraw/zinc/29/68/94/1050296894.db2.gz ABCHSEHQZHKHAI-QGZVFWFLSA-N 0 3 313.401 4.175 20 5 DIBDHN Cc1cccc2[nH]c(CNC(C)(C)c3ccc([N+](=O)[O-])cc3)cc21 ZINC000594940686 1050578107 /nfs/dbraw/zinc/57/81/07/1050578107.db2.gz QTZHAWOAMCQXCG-UHFFFAOYSA-N 0 3 323.396 4.409 20 5 DIBDHN Cc1cc(CNCc2c3ccccc3cc3ccccc32)n(C)n1 ZINC000790600439 1050976888 /nfs/dbraw/zinc/97/68/88/1050976888.db2.gz BWLQYEBOQILWFI-UHFFFAOYSA-N 0 3 315.420 4.325 20 5 DIBDHN Cc1cccc2c1CC[C@@H]2NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519721 1051587758 /nfs/dbraw/zinc/58/77/58/1051587758.db2.gz GEGLXFORZCECAG-INIZCTEOSA-N 0 3 316.788 4.334 20 5 DIBDHN CN(Cc1cnn(C)c1)Cc1c2ccccc2cc2ccccc21 ZINC000768199839 1051894654 /nfs/dbraw/zinc/89/46/54/1051894654.db2.gz KDAYCKNRCKSEEI-UHFFFAOYSA-N 0 3 315.420 4.359 20 5 DIBDHN F[C@@H]1CNCC[C@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217796327 1052144527 /nfs/dbraw/zinc/14/45/27/1052144527.db2.gz YQMMEMYEHFKPGL-WOJBJXKFSA-N 0 3 309.384 4.210 20 5 DIBDHN C[C@H](NCc1c(F)cccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000495401934 1052336007 /nfs/dbraw/zinc/33/60/07/1052336007.db2.gz OYAPOYPFDDWDKC-OLZOCXBDSA-N 0 3 302.349 4.016 20 5 DIBDHN Cc1ccc(CNC(C)(C)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000076901860 1052595620 /nfs/dbraw/zinc/59/56/20/1052595620.db2.gz DZISDKDQEZBABW-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN Cc1cc2cc(CN[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2[nH]1 ZINC000556898821 1052896434 /nfs/dbraw/zinc/89/64/34/1052896434.db2.gz RLCRLZGRZPHSJI-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN Cc1c([C@@H](C)N[C@H](C)c2ccc3n[nH]cc3c2)cccc1[N+](=O)[O-] ZINC000556921038 1052900582 /nfs/dbraw/zinc/90/05/82/1052900582.db2.gz LTUWOLNUNIOVNI-CHWSQXEVSA-N 0 3 324.384 4.191 20 5 DIBDHN Cc1c([C@@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)cccc1[N+](=O)[O-] ZINC000556921040 1052900921 /nfs/dbraw/zinc/90/09/21/1052900921.db2.gz LTUWOLNUNIOVNI-QWHCGFSZSA-N 0 3 324.384 4.191 20 5 DIBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCCC(F)F ZINC001343244031 1054438412 /nfs/dbraw/zinc/43/84/12/1054438412.db2.gz APICNBVVJJVBLF-UHFFFAOYSA-N 0 3 313.131 4.037 20 5 DIBDHN Cc1ccc(CN2CCC[C@@]2(C)c2ccccc2)cc1[N+](=O)[O-] ZINC001620540225 1055965299 /nfs/dbraw/zinc/96/52/99/1055965299.db2.gz JZGVIVUYHPZVOO-IBGZPJMESA-N 0 3 310.397 4.414 20 5 DIBDHN CC[C@H](C)N[C@@H](CNc1cc(C)sc1[N+](=O)[O-])c1ccco1 ZINC001612367581 1056278995 /nfs/dbraw/zinc/27/89/95/1056278995.db2.gz HHLXIUBPNLQGOU-GWCFXTLKSA-N 0 3 323.418 4.099 20 5 DIBDHN CC[C@H](C)N[C@@H](CNc1cc(C)ccc1[N+](=O)[O-])c1ccco1 ZINC001612367593 1056279141 /nfs/dbraw/zinc/27/91/41/1056279141.db2.gz HMEDZCVRZCFPGZ-ZFWWWQNUSA-N 0 3 317.389 4.038 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN(CC1CCCCC1)C1CC1 ZINC001615214609 1056477836 /nfs/dbraw/zinc/47/78/36/1056477836.db2.gz HLXRDQHXBHELHA-UHFFFAOYSA-N 0 3 318.417 4.148 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)[C@H]1CCC[C@@H](C)C1 ZINC001615302741 1056490075 /nfs/dbraw/zinc/49/00/75/1056490075.db2.gz JOGUBQJUVNWETD-ZBFHGGJFSA-N 0 3 320.433 4.393 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001616661814 1056697081 /nfs/dbraw/zinc/69/70/81/1056697081.db2.gz IZBDPEMFTSLDJL-CQSZACIVSA-N 0 3 310.397 4.243 20 5 DIBDHN CO[C@H](CNC(C)(C)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC001618196466 1056932571 /nfs/dbraw/zinc/93/25/71/1056932571.db2.gz NNYCFJUQIUSOGW-QGZVFWFLSA-N 0 3 320.433 4.015 20 5 DIBDHN CCC[C@@H](N[C@@H](C)c1cnccc1C)c1cccc([N+](=O)[O-])c1 ZINC000611299970 1057590490 /nfs/dbraw/zinc/59/04/90/1057590490.db2.gz UGRCVQHPUHWAHH-KBXCAEBGSA-N 0 3 313.401 4.490 20 5 DIBDHN CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1C[C@@H]1C1CCCCC1 ZINC001560359202 1060144716 /nfs/dbraw/zinc/14/47/16/1060144716.db2.gz FEKGEMHQJCCZNQ-SJORKVTESA-N 0 3 318.417 4.052 20 5 DIBDHN Cc1cc(C)nc(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 ZINC001560405554 1060190404 /nfs/dbraw/zinc/19/04/04/1060190404.db2.gz GUESBKZJMNCXRH-UHFFFAOYSA-N 0 3 323.352 4.479 20 5 DIBDHN CN1CCN(CCCc2ccc3cc4ccccc4cc3c2)CC1 ZINC001250229560 1060707758 /nfs/dbraw/zinc/70/77/58/1060707758.db2.gz XGYRJDGWVNRFPS-UHFFFAOYSA-N 0 3 318.464 4.173 20 5 DIBDHN Cc1c(CN2CC([C@@H]3CCC[C@H](C)C3)C2)cccc1[N+](=O)[O-] ZINC001560977761 1060842267 /nfs/dbraw/zinc/84/22/67/1060842267.db2.gz JSPLBKBJOZAVBN-DZGCQCFKSA-N 0 3 302.418 4.161 20 5 DIBDHN CCCCO[C@H]1C[C@@H](N[C@H](C)c2ccccc2[N+](=O)[O-])C1(C)C ZINC001560995447 1060857050 /nfs/dbraw/zinc/85/70/50/1060857050.db2.gz MNYBZKGAZHHRMF-XYPHTWIQSA-N 0 3 320.433 4.229 20 5 DIBDHN CN(Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCC[C@H]1C(C)(C)C ZINC001473565483 1061252052 /nfs/dbraw/zinc/25/20/52/1061252052.db2.gz TUCNQYMMLJAPBZ-CJNGLKHVSA-N 0 3 308.397 4.381 20 5 DIBDHN CN(Cc1c(F)cccc1[N+](=O)[O-])[C@H]1CCC[C@@H]1C(C)(C)C ZINC001473565482 1061252787 /nfs/dbraw/zinc/25/27/87/1061252787.db2.gz TUCNQYMMLJAPBZ-BBRMVZONSA-N 0 3 308.397 4.381 20 5 DIBDHN CC1(C)CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC(C)(C)C1 ZINC001473632259 1061302875 /nfs/dbraw/zinc/30/28/75/1061302875.db2.gz VANYFHIKXPJNQN-UHFFFAOYSA-N 0 3 308.397 4.382 20 5 DIBDHN C[C@@H](N[C@H](C)c1ccc2c(c1)CCC2)c1ccc([N+](=O)[O-])cc1 ZINC001473783739 1061409187 /nfs/dbraw/zinc/40/91/87/1061409187.db2.gz KNHWSTCVZMSAQY-ZIAGYGMSSA-N 0 3 310.397 4.495 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)CCC2)c1ccc([N+](=O)[O-])cc1 ZINC001473783738 1061409304 /nfs/dbraw/zinc/40/93/04/1061409304.db2.gz KNHWSTCVZMSAQY-KGLIPLIRSA-N 0 3 310.397 4.495 20 5 DIBDHN CC1(C)C[C@H](c2ccccc2)CN1Cc1csc([N+](=O)[O-])c1 ZINC001473845026 1061432468 /nfs/dbraw/zinc/43/24/68/1061432468.db2.gz DWQVVAHHQMTHJY-HNNXBMFYSA-N 0 3 316.426 4.424 20 5 DIBDHN CC(C)(NCc1cccc2ccoc21)c1ccc([N+](=O)[O-])cc1 ZINC001474424917 1062097950 /nfs/dbraw/zinc/09/79/50/1062097950.db2.gz TVQKZXXRTQVEGS-UHFFFAOYSA-N 0 3 310.353 4.366 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1cccc(Cl)c1F ZINC001254536828 1062164511 /nfs/dbraw/zinc/16/45/11/1062164511.db2.gz UHUPOVDTGIRHAQ-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])NCc1cc(Cl)ccc1F ZINC001254537310 1062165758 /nfs/dbraw/zinc/16/57/58/1062165758.db2.gz ZLVFXYBOZBWTTO-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])N[C@@H](C)c1c(F)cccc1F ZINC001254542891 1062170273 /nfs/dbraw/zinc/17/02/73/1062170273.db2.gz PRGOEDOJVSGRCC-NEPJUHHUSA-N 0 3 320.339 4.155 20 5 DIBDHN C[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001459512241 1062175875 /nfs/dbraw/zinc/17/58/75/1062175875.db2.gz FOGRVPBCFBZLGK-UXIGCNINSA-N 0 3 308.809 4.401 20 5 DIBDHN CCN(Cc1ccccc1F)[C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC001254560924 1062179376 /nfs/dbraw/zinc/17/93/76/1062179376.db2.gz ZSOFYOFSWKQFDF-AWEZNQCLSA-N 0 3 316.376 4.187 20 5 DIBDHN C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC=C(c2ccccc2)CC1 ZINC001254559165 1062180832 /nfs/dbraw/zinc/18/08/32/1062180832.db2.gz JBZNBARVKYKYDU-INIZCTEOSA-N 0 3 322.408 4.315 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC2(C1)CCCCC2 ZINC001474567633 1062270517 /nfs/dbraw/zinc/27/05/17/1062270517.db2.gz OBPWHTPXEJZCRA-GDNBJRDFSA-N 0 3 300.402 4.264 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc3ncccc3c2)cc1[N+](=O)[O-] ZINC001459824276 1062428741 /nfs/dbraw/zinc/42/87/41/1062428741.db2.gz JKOQSQSCSSFGRD-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CC1(C)CN(CCc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC001460207569 1062699093 /nfs/dbraw/zinc/69/90/93/1062699093.db2.gz VDSORYWJDUPAOF-MRXNPFEDSA-N 0 3 316.426 4.282 20 5 DIBDHN C[C@H](CN(C)Cc1ccc(F)cc1[N+](=O)[O-])C1CCCCC1 ZINC001460597047 1062927368 /nfs/dbraw/zinc/92/73/68/1062927368.db2.gz GSOJDUUKLUPTPJ-CYBMUJFWSA-N 0 3 308.397 4.382 20 5 DIBDHN CC(C)N1CCCC[C@@H]1CSc1ccc([N+](=O)[O-])cc1F ZINC001473014013 1063356693 /nfs/dbraw/zinc/35/66/93/1063356693.db2.gz LSQUGUVGSYAIAQ-CYBMUJFWSA-N 0 3 312.410 4.089 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H]1CCCc2ccccc21 ZINC001461797713 1063722496 /nfs/dbraw/zinc/72/24/96/1063722496.db2.gz LGDWQZBNHMKJNM-GOSISDBHSA-N 0 3 310.397 4.379 20 5 DIBDHN C[C@@H](CN(C)Cc1ccccc1[N+](=O)[O-])c1cc(F)cc(F)c1 ZINC001461892069 1063779440 /nfs/dbraw/zinc/77/94/40/1063779440.db2.gz LDMZIQMEYSECDE-LBPRGKRZSA-N 0 3 320.339 4.109 20 5 DIBDHN CC[C@H](NCc1cc(F)ccc1C)c1cccc([N+](=O)[O-])c1 ZINC001307633642 1065531548 /nfs/dbraw/zinc/53/15/48/1065531548.db2.gz HPJXZOLLHRZDMO-KRWDZBQOSA-N 0 3 302.349 4.283 20 5 DIBDHN CC[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H]1C ZINC001307703644 1065573541 /nfs/dbraw/zinc/57/35/41/1065573541.db2.gz WRKMWQOYPSDKNY-UONOGXRCSA-N 0 3 306.406 4.002 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CNCCOC1CCCCCC1 ZINC001308270739 1065869767 /nfs/dbraw/zinc/86/97/67/1065869767.db2.gz NQRNMICZHCGEAX-UHFFFAOYSA-N 0 3 320.433 4.041 20 5 DIBDHN CN(c1ccccc1)c1ccc(CN[C@H]2C=CCC2)cc1[N+](=O)[O-] ZINC001308457949 1066001487 /nfs/dbraw/zinc/00/14/87/1066001487.db2.gz MEUQQENUMXTHHK-INIZCTEOSA-N 0 3 323.396 4.171 20 5 DIBDHN CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1[O-] ZINC000903286749 1066100949 /nfs/dbraw/zinc/10/09/49/1066100949.db2.gz GDUCWWIDLNBSFG-MLGOLLRUSA-N 0 3 300.358 4.102 20 5 DIBDHN CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1[O-] ZINC000903287286 1066103870 /nfs/dbraw/zinc/10/38/70/1066103870.db2.gz NBMASGUTBAWCOI-CXAGYDPISA-N 0 3 314.385 4.411 20 5 DIBDHN Cc1ccc2cc(CN[C@H](C)c3ccc([N+](=O)[O-])cc3)ccc2n1 ZINC001308936657 1066408111 /nfs/dbraw/zinc/40/81/11/1066408111.db2.gz QCBJBROVKKNQPF-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN CCOc1ccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000078995817 185143017 /nfs/dbraw/zinc/14/30/17/185143017.db2.gz XXRGGTYLRNRFAR-KBPBESRZSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@@H](N[C@H]1CCCc2sccc21)c1ccc([N+](=O)[O-])cc1 ZINC000061359972 184169056 /nfs/dbraw/zinc/16/90/56/184169056.db2.gz XKBFJSKLYFGYKP-ABAIWWIYSA-N 0 3 302.399 4.385 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000273115077 130090707 /nfs/dbraw/zinc/09/07/07/130090707.db2.gz XDVNXAOMOJGOBS-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2C)cc1F ZINC000449373525 332088271 /nfs/dbraw/zinc/08/82/71/332088271.db2.gz RRSCQNKMWRDBHL-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN Cc1ccc(CN2CC[C@@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000560542547 332355757 /nfs/dbraw/zinc/35/57/57/332355757.db2.gz PCTFNARQUICVJP-OAHLLOKOSA-N 0 3 314.360 4.032 20 5 DIBDHN CC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1cccc(F)c1 ZINC000318448940 332730418 /nfs/dbraw/zinc/73/04/18/332730418.db2.gz BGURFONEACPUIQ-MRXNPFEDSA-N 0 3 302.349 4.283 20 5 DIBDHN C[C@@H](NCCc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000040444241 333353043 /nfs/dbraw/zinc/35/30/43/333353043.db2.gz SJTCRXPVSSNXNN-GFCCVEGCSA-N 0 3 304.777 4.142 20 5 DIBDHN Cc1ccc([C@H](NCc2cccc([N+](=O)[O-])c2C)C2CC2)cc1 ZINC000391110834 333420320 /nfs/dbraw/zinc/42/03/20/333420320.db2.gz UHASNLNPQWMSOL-IBGZPJMESA-N 0 3 310.397 4.453 20 5 DIBDHN COc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000414132897 333900265 /nfs/dbraw/zinc/90/02/65/333900265.db2.gz MXTSJVGJXJAIBO-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)COC2 ZINC000268811585 333994401 /nfs/dbraw/zinc/99/44/01/333994401.db2.gz OCQZHPBTRHTCLK-STQMWFEESA-N 0 3 312.369 4.037 20 5 DIBDHN Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000519180040 335813272 /nfs/dbraw/zinc/81/32/72/335813272.db2.gz GZXWOLHAVHWWSS-MSOLQXFVSA-N 0 3 308.381 4.168 20 5 DIBDHN CCOc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000192543756 336073715 /nfs/dbraw/zinc/07/37/15/336073715.db2.gz HLJTVVZXXCVJIC-ZIAGYGMSSA-N 0 3 314.385 4.405 20 5 DIBDHN CO[C@]1(C)CCCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000332230263 336164117 /nfs/dbraw/zinc/16/41/17/336164117.db2.gz OEZXVPQSIMLJKY-GOSISDBHSA-N 0 3 320.433 4.109 20 5 DIBDHN Cc1c(CN[C@@H]2CCCC[C@@H]2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000389482523 336395609 /nfs/dbraw/zinc/39/56/09/336395609.db2.gz QIQCCIZOWMCJGR-QWHCGFSZSA-N 0 3 316.323 4.114 20 5 DIBDHN CC[C@@H](N[C@H](C)c1ccc2n[nH]cc2c1)c1cccc([N+](=O)[O-])c1 ZINC000353970132 336451648 /nfs/dbraw/zinc/45/16/48/336451648.db2.gz BXBFGGQYZCGTRF-SJKOYZFVSA-N 0 3 324.384 4.273 20 5 DIBDHN Cc1oc2ccccc2c1CCNCc1csc([N+](=O)[O-])c1 ZINC000361743382 336770947 /nfs/dbraw/zinc/77/09/47/336770947.db2.gz GHDLVVOBNJXZND-UHFFFAOYSA-N 0 3 316.382 4.043 20 5 DIBDHN Cc1cc(NCCSC(C)C)c2cc([N+](=O)[O-])ccc2n1 ZINC000315159071 337981479 /nfs/dbraw/zinc/98/14/79/337981479.db2.gz WOKCUXOZZDLNKL-UHFFFAOYSA-N 0 3 305.403 4.005 20 5 DIBDHN CC(C)(C)OCCCCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429257884 338075034 /nfs/dbraw/zinc/07/50/34/338075034.db2.gz GCFYJCIYKBDRQU-UHFFFAOYSA-N 0 3 308.422 4.015 20 5 DIBDHN C[C@@H]1CCCC[C@H]1OCCNC(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429262112 338075210 /nfs/dbraw/zinc/07/52/10/338075210.db2.gz DJXZQCAEOZAOBU-RHSMWYFYSA-N 0 3 320.433 4.015 20 5 DIBDHN Cc1cccc(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000433131808 338182597 /nfs/dbraw/zinc/18/25/97/338182597.db2.gz DJLWSQYBRVFKJO-GOSISDBHSA-N 0 3 310.397 4.415 20 5 DIBDHN CSC1(CNCc2ccc(C(C)C)c([N+](=O)[O-])c2)CCC1 ZINC000433173511 338184041 /nfs/dbraw/zinc/18/40/41/338184041.db2.gz ICCJNDABKGPBRR-UHFFFAOYSA-N 0 3 308.447 4.094 20 5 DIBDHN C[C@@H]1[C@H](c2ccccc2)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000434900335 338227407 /nfs/dbraw/zinc/22/74/07/338227407.db2.gz CWHJGZXJUHUNEX-UKRRQHHQSA-N 0 3 314.360 4.112 20 5 DIBDHN Cc1ccc(CN[C@H]2C[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000435725650 338246293 /nfs/dbraw/zinc/24/62/93/338246293.db2.gz HWUOTUVHFULDII-JCNLHEQBSA-N 0 3 314.360 4.078 20 5 DIBDHN C[C@@H](NCc1cc2c(cccc2F)[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000436274159 338264967 /nfs/dbraw/zinc/26/49/67/338264967.db2.gz KQPFJSZBNUEOAF-LLVKDONJSA-N 0 3 313.332 4.066 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(Cl)s1 ZINC000449068403 338590228 /nfs/dbraw/zinc/59/02/28/338590228.db2.gz BJTJCKBYVKBPHR-SNVBAGLBSA-N 0 3 310.806 4.031 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC(CF)CC2)o1 ZINC000449464687 338627201 /nfs/dbraw/zinc/62/72/01/338627201.db2.gz YRWRNOCHURQROP-UHFFFAOYSA-N 0 3 318.348 4.036 20 5 DIBDHN C[C@@H](N[C@H]1CCCc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1 ZINC000453238496 338812525 /nfs/dbraw/zinc/81/25/25/338812525.db2.gz QJDUWLLKKQTOAC-XIKOKIGWSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1cc([C@@H](C)NCCOc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000195651104 338912417 /nfs/dbraw/zinc/91/24/17/338912417.db2.gz WGRBUPQPIRURLM-GFCCVEGCSA-N 0 3 320.414 4.003 20 5 DIBDHN C[C@H]1CCCc2ccccc2[C@@H]1NCc1ccc([N+](=O)[O-])cc1 ZINC000462542538 339080894 /nfs/dbraw/zinc/08/08/94/339080894.db2.gz NDZULZWYQYCTKV-IFXJQAMLSA-N 0 3 310.397 4.398 20 5 DIBDHN C[C@@H](Cc1ccccc1F)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000467835113 339247181 /nfs/dbraw/zinc/24/71/81/339247181.db2.gz YMPDYERXTWGUMW-STQMWFEESA-N 0 3 302.349 4.016 20 5 DIBDHN Cc1ccc(OCCCN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000467846636 339247491 /nfs/dbraw/zinc/24/74/91/339247491.db2.gz PJZWORRFLGEKSK-HNNXBMFYSA-N 0 3 314.385 4.023 20 5 DIBDHN Cc1ccc(O[C@@H](C)CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000467861607 339247923 /nfs/dbraw/zinc/24/79/23/339247923.db2.gz HTJFHTFIHGXCTC-LSDHHAIUSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccccc1O[C@H](C)CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467863509 339248079 /nfs/dbraw/zinc/24/80/79/339248079.db2.gz NXWZEDDSFJFQJG-HUUCEWRRSA-N 0 3 314.385 4.021 20 5 DIBDHN Cc1ccccc1O[C@@H](C)CN[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000467863510 339248105 /nfs/dbraw/zinc/24/81/05/339248105.db2.gz NXWZEDDSFJFQJG-LSDHHAIUSA-N 0 3 314.385 4.021 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1csc(Cl)c1 ZINC000467974269 339250376 /nfs/dbraw/zinc/25/03/76/339250376.db2.gz STTZJTORUYXPFY-SNVBAGLBSA-N 0 3 310.806 4.203 20 5 DIBDHN CCS[C@H]1CCCCN([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468229969 339256826 /nfs/dbraw/zinc/25/68/26/339256826.db2.gz JKFYTNXDIMGOAI-KGLIPLIRSA-N 0 3 308.447 4.263 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1ccc(C)s1 ZINC000468645311 339267887 /nfs/dbraw/zinc/26/78/87/339267887.db2.gz MMTHELXRCQLEGA-WQLSENKSSA-N 0 3 302.399 4.158 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)Cc1cccs1 ZINC000470171001 339312681 /nfs/dbraw/zinc/31/26/81/339312681.db2.gz DHMOONKZSSUEPK-LCYFTJDESA-N 0 3 302.399 4.192 20 5 DIBDHN Cc1ccc(C)c2c1CCC[C@@H]2NCc1ccc([N+](=O)[O-])cc1 ZINC000471612892 339349557 /nfs/dbraw/zinc/34/95/57/339349557.db2.gz HKCCCONBUXQHAG-SFHVURJKSA-N 0 3 310.397 4.379 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000475668553 339458961 /nfs/dbraw/zinc/45/89/61/339458961.db2.gz KCGYJTTUHZTATQ-KOMQPUFPSA-N 0 3 316.788 4.284 20 5 DIBDHN Cc1c(CN[C@@H]2CC(C)(C)c3ccccc32)cccc1[N+](=O)[O-] ZINC000478477221 339516236 /nfs/dbraw/zinc/51/62/36/339516236.db2.gz DYKUIOCLWYNNTA-QGZVFWFLSA-N 0 3 310.397 4.415 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@H]2CC[C@@H](c3ccccc3F)C2)cs1 ZINC000481820729 339614676 /nfs/dbraw/zinc/61/46/76/339614676.db2.gz YAYUPOJSDCTHLI-OLZOCXBDSA-N 0 3 320.389 4.221 20 5 DIBDHN CCC[C@@H](NC[C@@H](OC)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000483852027 339676487 /nfs/dbraw/zinc/67/64/87/339676487.db2.gz MCFKDQNSACGIQV-HZPDHXFCSA-N 0 3 308.422 4.087 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CS[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000488447534 339782957 /nfs/dbraw/zinc/78/29/57/339782957.db2.gz WPRCJUTXVJDGIB-NOLJZWGESA-N 0 3 308.447 4.084 20 5 DIBDHN CCOc1cc(CNC(C)(C)c2cccs2)ccc1[N+](=O)[O-] ZINC000492876497 339911254 /nfs/dbraw/zinc/91/12/54/339911254.db2.gz WJBQXFRSWZFFDP-UHFFFAOYSA-N 0 3 320.414 4.080 20 5 DIBDHN CCSCCCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000500371734 340055910 /nfs/dbraw/zinc/05/59/10/340055910.db2.gz MBRJGSWEWKLTMX-UHFFFAOYSA-N 0 3 320.414 4.088 20 5 DIBDHN CC[C@@H]1C[C@@]1(NCc1cccc([N+](=O)[O-])c1)c1cccc(C)c1 ZINC000500537665 340061771 /nfs/dbraw/zinc/06/17/71/340061771.db2.gz UKRVGPXTBLZSSK-APWZRJJASA-N 0 3 310.397 4.318 20 5 DIBDHN CCN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000506009816 340183153 /nfs/dbraw/zinc/18/31/53/340183153.db2.gz MLFIHFXHSXSEBB-VMPITWQZSA-N 0 3 302.399 4.192 20 5 DIBDHN Cc1ccsc1CN(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000506056096 340184511 /nfs/dbraw/zinc/18/45/11/340184511.db2.gz QENPUUWWJXDNRJ-FNORWQNLSA-N 0 3 302.399 4.110 20 5 DIBDHN COc1ccc(CN(C)CCC2CCCCC2)cc1[N+](=O)[O-] ZINC000507621013 340226694 /nfs/dbraw/zinc/22/66/94/340226694.db2.gz XNOKFCVFDOZQNG-UHFFFAOYSA-N 0 3 306.406 4.006 20 5 DIBDHN Cc1ccccc1[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000507907774 340235643 /nfs/dbraw/zinc/23/56/43/340235643.db2.gz WVDMWKWQEMJFGC-CQSZACIVSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@H](NCc1c(F)cc([N+](=O)[O-])cc1F)[C@@H](C)c1ccccc1 ZINC000509009150 340258025 /nfs/dbraw/zinc/25/80/25/340258025.db2.gz XTXKYGKBSAOLAQ-NEPJUHHUSA-N 0 3 320.339 4.155 20 5 DIBDHN C[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)[C@@H](C)c1ccccc1 ZINC000509009153 340258072 /nfs/dbraw/zinc/25/80/72/340258072.db2.gz XTXKYGKBSAOLAQ-VXGBXAGGSA-N 0 3 320.339 4.155 20 5 DIBDHN CSCc1ccc(CNCc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000512977656 340386636 /nfs/dbraw/zinc/38/66/36/340386636.db2.gz PTSPSIRMHRGOSZ-UHFFFAOYSA-N 0 3 316.426 4.056 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](C)c1ccc2n[nH]cc2c1 ZINC000513189417 340396075 /nfs/dbraw/zinc/39/60/75/340396075.db2.gz YAMLBKKOAOGHRR-OLZOCXBDSA-N 0 3 324.384 4.191 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N[C@H](C)c1ccc2n[nH]cc2c1 ZINC000513189416 340396214 /nfs/dbraw/zinc/39/62/14/340396214.db2.gz YAMLBKKOAOGHRR-CHWSQXEVSA-N 0 3 324.384 4.191 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H]2CCc3c2cccc3F)cc1[N+](=O)[O-] ZINC000513856852 340428810 /nfs/dbraw/zinc/42/88/10/340428810.db2.gz CJPYAEYWOWQWNQ-SJCJKPOMSA-N 0 3 314.360 4.380 20 5 DIBDHN CC[C@H](N[C@@H]1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC000513858278 340428812 /nfs/dbraw/zinc/42/88/12/340428812.db2.gz XBUSEECRZANIJV-ZWKOTPCHSA-N 0 3 314.360 4.462 20 5 DIBDHN Cc1c(CN[C@H](C)c2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000038092352 340789545 /nfs/dbraw/zinc/78/95/45/340789545.db2.gz VYLJEYXPVMMHSA-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN Cc1ccccc1OCCCN[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000538224493 340814138 /nfs/dbraw/zinc/81/41/38/340814138.db2.gz DREDPAKKWBUFOM-HNNXBMFYSA-N 0 3 314.385 4.023 20 5 DIBDHN CC[C@H](NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)(C)C ZINC000538392098 340820244 /nfs/dbraw/zinc/82/02/44/340820244.db2.gz JYKOCTUHBJAJMM-HNNXBMFYSA-N 0 3 317.389 4.164 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](c1cccnc1)C1CC1 ZINC000539051931 340867923 /nfs/dbraw/zinc/86/79/23/340867923.db2.gz PULUJLDFHZVBDA-UGSOOPFHSA-N 0 3 311.385 4.100 20 5 DIBDHN C[C@H](NCCc1cc2ccccc2o1)c1ccc([N+](=O)[O-])cc1 ZINC000539076221 340870916 /nfs/dbraw/zinc/87/09/16/340870916.db2.gz MSDODIJSUYVKKT-ZDUSSCGKSA-N 0 3 310.353 4.234 20 5 DIBDHN CC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000539092111 340872701 /nfs/dbraw/zinc/87/27/01/340872701.db2.gz XAWAUZZSONQOKY-ACJLOTCBSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1ccc(CC[C@@H](C)NCc2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000544354609 341077847 /nfs/dbraw/zinc/07/78/47/341077847.db2.gz HXQUEOLNJRKFIR-LLVKDONJSA-N 0 3 322.792 4.261 20 5 DIBDHN Cc1[nH]c2ccc(CNCc3ccc([N+](=O)[O-])cc3C)cc2c1C ZINC000544603742 341088243 /nfs/dbraw/zinc/08/82/43/341088243.db2.gz DCQQUUUDCWOZDS-UHFFFAOYSA-N 0 3 323.396 4.291 20 5 DIBDHN COc1ccc(CN[C@H](C)c2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000544842547 341095931 /nfs/dbraw/zinc/09/59/31/341095931.db2.gz FYNKGVKABVNPPT-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN COc1ccc(CN[C@@H](C)c2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000544842546 341095956 /nfs/dbraw/zinc/09/59/56/341095956.db2.gz FYNKGVKABVNPPT-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H]1c1ccncc1 ZINC000564314069 341198264 /nfs/dbraw/zinc/19/82/64/341198264.db2.gz AYRZUAJKORMCCZ-LBKOFNPBSA-N 0 3 323.396 4.230 20 5 DIBDHN Cc1ccc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000080347293 341273010 /nfs/dbraw/zinc/27/30/10/341273010.db2.gz YRYZUCVILSCJPV-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CNCc1coc2ccccc12 ZINC000549823705 341304132 /nfs/dbraw/zinc/30/41/32/341304132.db2.gz XFVOITLGAJVSKT-FNORWQNLSA-N 0 3 308.337 4.144 20 5 DIBDHN CC(C)[C@H]1CC[C@H]1NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000552055938 341365578 /nfs/dbraw/zinc/36/55/78/341365578.db2.gz JXAQTIIMHZUCTN-ZIAGYGMSSA-N 0 3 316.323 4.138 20 5 DIBDHN Cc1c([C@@H](C)N[C@H](c2cccnc2)C2CC2)cccc1[N+](=O)[O-] ZINC000552580311 341399718 /nfs/dbraw/zinc/39/97/18/341399718.db2.gz ZOULSIOWPZOKSD-ACJLOTCBSA-N 0 3 311.385 4.100 20 5 DIBDHN O=[N+]([O-])c1cccc(CN[C@H]2C[C@H](c3ccccc3Cl)C2)c1 ZINC000555643513 341487919 /nfs/dbraw/zinc/48/79/19/341487919.db2.gz RVKLXBGNRMIWGD-HDJSIYSDSA-N 0 3 316.788 4.284 20 5 DIBDHN CC[C@@H](N[C@@H]1CCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000178675593 341961483 /nfs/dbraw/zinc/96/14/83/341961483.db2.gz DGWNSMQMAQVEAY-QZTJIDSGSA-N 0 3 314.360 4.462 20 5 DIBDHN CCCO[C@@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000245530279 520274785 /nfs/dbraw/zinc/27/47/85/520274785.db2.gz SIQCBHRAQJBUHH-NVXWUHKLSA-N 0 3 320.433 4.245 20 5 DIBDHN CSCc1cccc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000188715667 525739937 /nfs/dbraw/zinc/73/99/37/525739937.db2.gz RVCHETCQEILRHZ-ZDUSSCGKSA-N 0 3 316.426 4.309 20 5 DIBDHN CSCc1cccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000188722907 525740146 /nfs/dbraw/zinc/74/01/46/525740146.db2.gz AFJXKWUBXQZSJB-ZDUSSCGKSA-N 0 3 316.426 4.309 20 5 DIBDHN CSC[C@H]1CCCN1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000538751981 1035819933 /nfs/dbraw/zinc/81/99/33/1035819933.db2.gz AAYOEPVUFIWBBE-CQSZACIVSA-N 0 3 308.447 4.046 20 5 DIBDHN CC[C@@H](C)[C@H](C)N(Cc1cc(OC)c(F)cc1[N+](=O)[O-])C1CC1 ZINC001167356102 1036963514 /nfs/dbraw/zinc/96/35/14/1036963514.db2.gz JKSYBZKBRWYUQV-NEPJUHHUSA-N 0 3 324.396 4.142 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CCc3cc(F)ccc32)cc1[N+](=O)[O-] ZINC000178087916 1037815064 /nfs/dbraw/zinc/81/50/64/1037815064.db2.gz MMBOMOHKWLWYLZ-YVEFUNNKSA-N 0 3 314.360 4.380 20 5 DIBDHN CCC[C@@H]1[C@H](C)CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582554 1038202944 /nfs/dbraw/zinc/20/29/44/1038202944.db2.gz XTEIMDQGGIYWLA-IUODEOHRSA-N 0 3 317.389 4.137 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC2(CC2(F)F)CC1 ZINC000593671570 1038232096 /nfs/dbraw/zinc/23/20/96/1038232096.db2.gz KUOBRBHUXVZHCZ-LCYFTJDESA-N 0 3 322.355 4.119 20 5 DIBDHN CC(C)C[C@@H]1CCCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610710616 1038268104 /nfs/dbraw/zinc/26/81/04/1038268104.db2.gz ANGVVCLQEPHDBE-ZDUSSCGKSA-N 0 3 317.389 4.137 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cc3ccccc3[nH]2)cc1[N+](=O)[O-] ZINC000610806631 1038352992 /nfs/dbraw/zinc/35/29/92/1038352992.db2.gz WWVQPNPSIVQUGZ-ZDUSSCGKSA-N 0 3 309.369 4.235 20 5 DIBDHN CCCOc1ccc([C@@H](C)NCc2cccc([N+](=O)[O-])c2)cc1 ZINC000320330468 1038464584 /nfs/dbraw/zinc/46/45/84/1038464584.db2.gz YJJNKTNXOJURHF-CQSZACIVSA-N 0 3 314.385 4.234 20 5 DIBDHN CCCOc1ccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178646399 1038834808 /nfs/dbraw/zinc/83/48/08/1038834808.db2.gz AQIFCQDSBKXVTM-CQSZACIVSA-N 0 3 314.385 4.234 20 5 DIBDHN Cc1ccccc1[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)C1CC1 ZINC000283227351 1039213218 /nfs/dbraw/zinc/21/32/18/1039213218.db2.gz TYWWBPRTRBGEAS-SFHVURJKSA-N 0 3 314.360 4.283 20 5 DIBDHN CC[C@H](NCc1cccc(OC)c1C)c1cccc([N+](=O)[O-])c1 ZINC000595102244 1039388741 /nfs/dbraw/zinc/38/87/41/1039388741.db2.gz DIFJIQMNOKVYLM-KRWDZBQOSA-N 0 3 314.385 4.153 20 5 DIBDHN COc1cc(C)cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000540147406 1039426966 /nfs/dbraw/zinc/42/69/66/1039426966.db2.gz RAPZTUNKXLLPRZ-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN C[C@H](N[C@@H](c1cccs1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000480247770 1039601648 /nfs/dbraw/zinc/60/16/48/1039601648.db2.gz MYUNFJYGHLQJHA-MEDUHNTESA-N 0 3 302.399 4.458 20 5 DIBDHN C[C@@H](N[C@@H]1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC000081181375 1039702380 /nfs/dbraw/zinc/70/23/80/1039702380.db2.gz DLRNCIRPOHFQBB-PIGZYNQJSA-N 0 3 300.333 4.072 20 5 DIBDHN C[C@@H](N[C@H]1CCCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000092856837 1039888029 /nfs/dbraw/zinc/88/80/29/1039888029.db2.gz KCXHVUFFBZMMBM-XIKOKIGWSA-N 0 3 314.360 4.462 20 5 DIBDHN CC(C)(NC/C=C\c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000492442699 1039962150 /nfs/dbraw/zinc/96/21/50/1039962150.db2.gz PTDJCFSZEPSBIE-WAYWQWQTSA-N 0 3 314.360 4.272 20 5 DIBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCC1(F)CCC1 ZINC000811507464 1041533402 /nfs/dbraw/zinc/53/34/02/1041533402.db2.gz CZEGZIDEMPNTCC-UHFFFAOYSA-N 0 3 321.179 4.274 20 5 DIBDHN Cc1cccc([C@@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1C ZINC000815580487 1041965572 /nfs/dbraw/zinc/96/55/72/1041965572.db2.gz LEFAYFIIUPJVMQ-UONOGXRCSA-N 0 3 313.401 4.206 20 5 DIBDHN CC(C)c1cccc(CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815617943 1041975512 /nfs/dbraw/zinc/97/55/12/1041975512.db2.gz YZKBIYCSKNPMBK-CYBMUJFWSA-N 0 3 313.401 4.151 20 5 DIBDHN CN(Cc1csc([N+](=O)[O-])c1)[C@H]1CCC[C@H]1c1ccccc1 ZINC001171019853 1042327232 /nfs/dbraw/zinc/32/72/32/1042327232.db2.gz XRNUWANITMOLBX-HOTGVXAUSA-N 0 3 316.426 4.424 20 5 DIBDHN Cc1ccc(CN(C)C/C=C/c2ccccc2[N+](=O)[O-])s1 ZINC000513418517 1042539081 /nfs/dbraw/zinc/53/90/81/1042539081.db2.gz BPCPLICZXKXQNI-FNORWQNLSA-N 0 3 302.399 4.110 20 5 DIBDHN Cc1ccc(CN2CC[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000513467133 1042544636 /nfs/dbraw/zinc/54/46/36/1042544636.db2.gz QIJAWDCIMRDHRG-MRXNPFEDSA-N 0 3 314.360 4.032 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H]2CCc3c2cccc3F)cc1[N+](=O)[O-] ZINC000513856851 1042759336 /nfs/dbraw/zinc/75/93/36/1042759336.db2.gz CJPYAEYWOWQWNQ-PXAZEXFGSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1oc2ccccc2c1CN[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000518215188 1042911480 /nfs/dbraw/zinc/91/14/80/1042911480.db2.gz OPLUKLKCBZKGDA-KRWDZBQOSA-N 0 3 322.364 4.427 20 5 DIBDHN Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000519180043 1042936188 /nfs/dbraw/zinc/93/61/88/1042936188.db2.gz GZXWOLHAVHWWSS-ZWKOTPCHSA-N 0 3 308.381 4.168 20 5 DIBDHN C[C@@H](Cc1ccsc1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000049156093 1043134895 /nfs/dbraw/zinc/13/48/95/1043134895.db2.gz PQTANQHIPUHOJQ-JTQLQIEISA-N 0 3 310.806 4.031 20 5 DIBDHN CC[C@@H](C)CN(CC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536349642 1043140050 /nfs/dbraw/zinc/14/00/50/1043140050.db2.gz SVAMUCDVAHBVLA-CYBMUJFWSA-N 0 3 317.389 4.118 20 5 DIBDHN CC[C@H](C)CN(CC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000536349643 1043140262 /nfs/dbraw/zinc/14/02/62/1043140262.db2.gz SVAMUCDVAHBVLA-ZDUSSCGKSA-N 0 3 317.389 4.118 20 5 DIBDHN C[C@@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000866607004 1043231936 /nfs/dbraw/zinc/23/19/36/1043231936.db2.gz MJQNPINDASVUBQ-LERXQTSPSA-N 0 3 314.307 4.143 20 5 DIBDHN CC[C@@H](N[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccncc1 ZINC000192895650 1043278402 /nfs/dbraw/zinc/27/84/02/1043278402.db2.gz RUMBAPLYEFHRPS-QZTJIDSGSA-N 0 3 311.385 4.108 20 5 DIBDHN COc1ccc([C@@H](C)N[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000268860898 1043339370 /nfs/dbraw/zinc/33/93/70/1043339370.db2.gz BUZZBJDADMLQIT-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@H](NCC[C@]1(C)C[C@]1(F)Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872084466 1043454451 /nfs/dbraw/zinc/45/44/51/1043454451.db2.gz SJRHBIGUISWFFF-CUOATXAZSA-N 0 3 318.751 4.089 20 5 DIBDHN C[C@@H](NCC(C)(C)C(C)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872091321 1043456658 /nfs/dbraw/zinc/45/66/58/1043456658.db2.gz GNMSTARYFUBLCC-SECBINFHSA-N 0 3 304.312 4.066 20 5 DIBDHN CC1=C(c2ccco2)CN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000558733564 1043582494 /nfs/dbraw/zinc/58/24/94/1043582494.db2.gz HQSCIAOPDZXMLC-CQSZACIVSA-N 0 3 312.369 4.428 20 5 DIBDHN Cc1c(CN[C@H]2CCCc3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000357706072 1043978895 /nfs/dbraw/zinc/97/88/95/1043978895.db2.gz JSUINDCFWQAWEJ-KRWDZBQOSA-N 0 3 314.360 4.210 20 5 DIBDHN CC[C@@H](NCc1cccc([N+](=O)[O-])c1C)c1cccc(OC)c1 ZINC000358327063 1044053969 /nfs/dbraw/zinc/05/39/69/1044053969.db2.gz SXWGSDBQDAWREW-QGZVFWFLSA-N 0 3 314.385 4.153 20 5 DIBDHN COCC[C@@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000932176705 1044107806 /nfs/dbraw/zinc/10/78/06/1044107806.db2.gz ABQUAUUSZGCOMG-RDTXWAMCSA-N 0 3 314.385 4.023 20 5 DIBDHN Cc1c(CN[C@H]2CCc3c2cccc3Cl)cccc1[N+](=O)[O-] ZINC000565867881 1044460964 /nfs/dbraw/zinc/46/09/64/1044460964.db2.gz OGEGHMNIWKNDDA-INIZCTEOSA-N 0 3 316.788 4.334 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](CC(F)(F)F)C1 ZINC000444708408 1044612186 /nfs/dbraw/zinc/61/21/86/1044612186.db2.gz QSCUDNFBSPOHGQ-NEPJUHHUSA-N 0 3 316.323 4.239 20 5 DIBDHN CC[C@H](NCc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000037507779 1044712887 /nfs/dbraw/zinc/71/28/87/1044712887.db2.gz VVQOQIFLRPMGJU-INIZCTEOSA-N 0 3 304.777 4.489 20 5 DIBDHN C[C@H](Cc1ccccc1Cl)NCc1csc([N+](=O)[O-])c1 ZINC000037562768 1044782535 /nfs/dbraw/zinc/78/25/35/1044782535.db2.gz OPDWFKPZPPSBAH-SNVBAGLBSA-N 0 3 310.806 4.031 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN[C@@H]1CCC[C@H]1c1ccccc1 ZINC000445995328 1044870400 /nfs/dbraw/zinc/87/04/00/1044870400.db2.gz SMEDOOPBFAFRGV-WMLDXEAASA-N 0 3 314.360 4.160 20 5 DIBDHN Cc1ccccc1[C@H]1C[C@@H](C)N(Cc2csc([N+](=O)[O-])c2)C1 ZINC000524595050 1044882623 /nfs/dbraw/zinc/88/26/23/1044882623.db2.gz AFVLUNZJLXJAGM-HIFRSBDPSA-N 0 3 316.426 4.343 20 5 DIBDHN CCOc1ccc([C@H](C)NCc2ccc(C)s2)cc1[N+](=O)[O-] ZINC000152983078 1045051502 /nfs/dbraw/zinc/05/15/02/1045051502.db2.gz WXZYPXQPFPIHET-LBPRGKRZSA-N 0 3 320.414 4.214 20 5 DIBDHN Cc1cc([C@@H](NCc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000158728145 1045060025 /nfs/dbraw/zinc/06/00/25/1045060025.db2.gz OYPGBLXGBBJMFT-SFHVURJKSA-N 0 3 314.360 4.283 20 5 DIBDHN Cc1ccc([C@H](C)N[C@H]2CCCc3ncccc32)cc1[N+](=O)[O-] ZINC000601271831 1045209195 /nfs/dbraw/zinc/20/91/95/1045209195.db2.gz UXBAUTCSUQESPQ-GUYCJALGSA-N 0 3 311.385 4.026 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2ccc(CN3CC(C4CCC4)C3)o2)c1 ZINC000578470059 1045245670 /nfs/dbraw/zinc/24/56/70/1045245670.db2.gz MNSVEMSVUHPOHJ-UHFFFAOYSA-N 0 3 312.369 4.087 20 5 DIBDHN CCc1cnccc1[C@@H](C)N[C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000579270051 1045303175 /nfs/dbraw/zinc/30/31/75/1045303175.db2.gz MNHQMGFDULUJIG-ZIAGYGMSSA-N 0 3 313.401 4.272 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN2CC(C3CCC3)C2)o1 ZINC000579577686 1045323868 /nfs/dbraw/zinc/32/38/68/1045323868.db2.gz LWNYSBHEBQZVPP-UHFFFAOYSA-N 0 3 312.369 4.087 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1ccc2ncccc2c1 ZINC000530365705 1045652723 /nfs/dbraw/zinc/65/27/23/1045652723.db2.gz ANIICZZKWGFSFP-CQSZACIVSA-N 0 3 321.380 4.302 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H](c2cccs2)C2CC2)cc1F ZINC000801527926 1045731802 /nfs/dbraw/zinc/73/18/02/1045731802.db2.gz OORXIUJQJFLQAL-HNNXBMFYSA-N 0 3 306.362 4.036 20 5 DIBDHN Cc1ccc([C@@H]2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)C2)cc1 ZINC000801539926 1045733136 /nfs/dbraw/zinc/73/31/36/1045733136.db2.gz QZJPWDJWKOKGIY-MRXNPFEDSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@H]1CCC(C)(C)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000452004950 1045763710 /nfs/dbraw/zinc/76/37/10/1045763710.db2.gz IRFNVMHKEUDKNC-LBPRGKRZSA-N 0 3 315.373 4.013 20 5 DIBDHN C[C@@H]1CCC(C)(C)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000452004947 1045764621 /nfs/dbraw/zinc/76/46/21/1045764621.db2.gz IRFNVMHKEUDKNC-GFCCVEGCSA-N 0 3 315.373 4.013 20 5 DIBDHN CC(C)(C)SCCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000801936137 1045852574 /nfs/dbraw/zinc/85/25/74/1045852574.db2.gz POKCFWONQRTKQS-UHFFFAOYSA-N 0 3 308.447 4.091 20 5 DIBDHN CN(Cc1cncnc1)Cc1c2ccccc2cc2ccccc21 ZINC001137669361 1045928216 /nfs/dbraw/zinc/92/82/16/1045928216.db2.gz PHOJWGXTVKWQPK-UHFFFAOYSA-N 0 3 313.404 4.415 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H](c2ccncc2)C2CC2)cc1[N+](=O)[O-] ZINC000903427632 1046277330 /nfs/dbraw/zinc/27/73/30/1046277330.db2.gz IAVIBHDZAOEWHC-FZKQIMNGSA-N 0 3 311.385 4.100 20 5 DIBDHN Cc1c([C@@H](C)N[C@H]2CCc3ccc(F)cc32)cccc1[N+](=O)[O-] ZINC000089552417 1046289812 /nfs/dbraw/zinc/28/98/12/1046289812.db2.gz YNMYTORDCVGYFW-PXAZEXFGSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1nc([C@@H](C)NC[C@H](C)c2ccccc2[N+](=O)[O-])c(C)s1 ZINC000897466216 1046440515 /nfs/dbraw/zinc/44/05/15/1046440515.db2.gz PUFDJYAAYATYFD-WDEREUQCSA-N 0 3 319.430 4.122 20 5 DIBDHN CCC(C)(C)N(C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000093279285 1046619092 /nfs/dbraw/zinc/61/90/92/1046619092.db2.gz QLALYOLSBOWEBO-UHFFFAOYSA-N 0 3 319.430 4.339 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783739987 1046629270 /nfs/dbraw/zinc/62/92/70/1046629270.db2.gz FZJNAJACEZVIJM-LLVKDONJSA-N 0 3 324.730 4.315 20 5 DIBDHN Cc1cc(F)ccc1[C@H](C)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000834813995 1046674687 /nfs/dbraw/zinc/67/46/87/1046674687.db2.gz BZPJSMVAEYTJSH-STQMWFEESA-N 0 3 302.349 4.454 20 5 DIBDHN Cc1ccc([C@@H]2CCN(Cc3cc(F)ccc3[N+](=O)[O-])C2)cc1 ZINC000784479010 1046691817 /nfs/dbraw/zinc/69/18/17/1046691817.db2.gz ZQPLZKCBXOUFEU-OAHLLOKOSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@@H](Cc1ccc(Cl)cc1)N(C)Cc1ccccc1[N+](=O)[O-] ZINC000303931724 1047005462 /nfs/dbraw/zinc/00/54/62/1047005462.db2.gz XIPOQSICXWRLQN-ZDUSSCGKSA-N 0 3 318.804 4.311 20 5 DIBDHN CCC[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000089513343 1047390403 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DIBDHN C[C@H](N[C@H](c1cccs1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000480247771 1048103949 /nfs/dbraw/zinc/10/39/49/1048103949.db2.gz MYUNFJYGHLQJHA-ZBEGNZNMSA-N 0 3 302.399 4.458 20 5 DIBDHN C[C@@H](N[C@H](c1cccs1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000480247768 1048103992 /nfs/dbraw/zinc/10/39/92/1048103992.db2.gz MYUNFJYGHLQJHA-BZNIZROVSA-N 0 3 302.399 4.458 20 5 DIBDHN C/C=C\C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC001175052530 1048112496 /nfs/dbraw/zinc/11/24/96/1048112496.db2.gz GXNFIRMPJFWMIV-UYWPIULCSA-N 0 3 318.417 4.172 20 5 DIBDHN Cc1cc(C)c(/C=C\CNCc2ccc([N+](=O)[O-])cc2)cc1C ZINC001177416090 1048887815 /nfs/dbraw/zinc/88/78/15/1048887815.db2.gz HZDKIOGRWNSCOE-PLNGDYQASA-N 0 3 310.397 4.323 20 5 DIBDHN CCC[C@]1(C)CCCN(Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001191258523 1048895101 /nfs/dbraw/zinc/89/51/01/1048895101.db2.gz NLOWBOGZXLYKLB-QGZVFWFLSA-N 0 3 306.406 4.006 20 5 DIBDHN C/C(=C/c1ccccc1)CN(C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001193372882 1049203516 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CCCC[C@@H]1CCC[C@H]1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000617220455 1053117819 /nfs/dbraw/zinc/11/78/19/1053117819.db2.gz BEVIRLWPHINCMU-TZMCWYRMSA-N 0 3 317.389 4.185 20 5 DIBDHN Cc1cccc2c1ncc(C)c2N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001320369590 1053328973 /nfs/dbraw/zinc/32/89/73/1053328973.db2.gz UBVRZEOKZZGDEM-UHFFFAOYSA-N 0 3 319.364 4.280 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CNC(C)(C)c1cccc(F)c1 ZINC000183479048 1053665974 /nfs/dbraw/zinc/66/59/74/1053665974.db2.gz ASSYZNDAZPHWGP-UHFFFAOYSA-N 0 3 302.349 4.067 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1cccc(C(F)F)c1 ZINC001329941362 1054010367 /nfs/dbraw/zinc/01/03/67/1054010367.db2.gz PSTZCBRMJDASQX-OAHLLOKOSA-N 0 3 318.323 4.310 20 5 DIBDHN CC(C)(NCc1cncc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC001342571410 1054425134 /nfs/dbraw/zinc/42/51/34/1054425134.db2.gz SKQNPVGDDVTFIJ-UHFFFAOYSA-N 0 3 321.380 4.168 20 5 DIBDHN CC[C@H](C)N[C@H](CNc1cc(C)ccc1[N+](=O)[O-])c1ccco1 ZINC001612367590 1056280134 /nfs/dbraw/zinc/28/01/34/1056280134.db2.gz 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Cc1ccc([C@@H](C)NCc2ccc3cc[nH]c3c2)cc1[N+](=O)[O-] ZINC001559686802 1059516321 /nfs/dbraw/zinc/51/63/21/1059516321.db2.gz PDKBDRVNKKQSFO-CYBMUJFWSA-N 0 3 309.369 4.235 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCCC2(CCCC2)CC1 ZINC001559992251 1059796096 /nfs/dbraw/zinc/79/60/96/1059796096.db2.gz UUARRBCVONHDOG-UHFFFAOYSA-N 0 3 306.381 4.280 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCC[C@H](C2CCC2)CC1 ZINC001560091408 1059901530 /nfs/dbraw/zinc/90/15/30/1059901530.db2.gz IYCVFFXCUMRJBB-AWEZNQCLSA-N 0 3 306.381 4.136 20 5 DIBDHN CC[C@H]1CCC[C@H](CN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001560697978 1060549677 /nfs/dbraw/zinc/54/96/77/1060549677.db2.gz WSDHJOFHVAEBDZ-GJZGRUSLSA-N 0 3 302.418 4.169 20 5 DIBDHN O=[N+]([O-])c1ccc2oc(CNCCC3=CCCCCC3)nc2c1 ZINC001560736173 1060603733 /nfs/dbraw/zinc/60/37/33/1060603733.db2.gz NHRSECOQJZNJHI-UHFFFAOYSA-N 0 3 315.373 4.106 20 5 DIBDHN CCN(Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC1CCC1 ZINC001560781931 1060644674 /nfs/dbraw/zinc/64/46/74/1060644674.db2.gz JFFOWXSFLHFNMQ-UHFFFAOYSA-N 0 3 316.323 4.236 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCc2cc(C)ccc2C1 ZINC001560894861 1060757186 /nfs/dbraw/zinc/75/71/86/1060757186.db2.gz WYVDRAJXBXXSGU-MHWRWJLKSA-N 0 3 322.408 4.365 20 5 DIBDHN O=[N+]([O-])c1ncccc1CN1CCC[C@@H]1CCC1CCCCC1 ZINC001473279047 1061051732 /nfs/dbraw/zinc/05/17/32/1061051732.db2.gz QXDDWNGYXDMMCK-QGZVFWFLSA-N 0 3 317.433 4.315 20 5 DIBDHN CC[C@H]1[C@@H](C)CCN1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001473411410 1061145454 /nfs/dbraw/zinc/14/54/54/1061145454.db2.gz ZFFRVFJDWODLMX-BBRMVZONSA-N 0 3 306.406 4.002 20 5 DIBDHN C[C@@H](N[C@H]1CS[C@@H](C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC001462556597 1061260005 /nfs/dbraw/zinc/26/00/05/1061260005.db2.gz MKKVRROJAXHFKK-LALPHHSUSA-N 0 3 308.447 4.166 20 5 DIBDHN CC1(C)CCC[C@H]1[C@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC001473576818 1061266400 /nfs/dbraw/zinc/26/64/00/1061266400.db2.gz BQGJNGJNZPSITR-ZFWWWQNUSA-N 0 3 320.408 4.382 20 5 DIBDHN CC(C)[C@@H]1C[C@H]1NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001462683542 1061336226 /nfs/dbraw/zinc/33/62/26/1061336226.db2.gz BDHSNPYGKHMKOY-CMPLNLGQSA-N 0 3 303.189 4.036 20 5 DIBDHN CC1(C)C[C@@H](c2ccccc2)CN1Cc1csc([N+](=O)[O-])c1 ZINC001473845027 1061431393 /nfs/dbraw/zinc/43/13/93/1061431393.db2.gz DWQVVAHHQMTHJY-OAHLLOKOSA-N 0 3 316.426 4.424 20 5 DIBDHN Cc1cc(Cl)cc(C)c1CNCc1ccc([N+](=O)[O-])cc1 ZINC001473948094 1061490645 /nfs/dbraw/zinc/49/06/45/1061490645.db2.gz JWAOFMVRWYXVOF-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN C[C@H](CNCc1c(F)cccc1Cl)c1ccccc1[N+](=O)[O-] ZINC001474283985 1061851998 /nfs/dbraw/zinc/85/19/98/1061851998.db2.gz XSFHEMLFGLBVRC-LLVKDONJSA-N 0 3 322.767 4.281 20 5 DIBDHN C[C@@H]1CCCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001474451354 1062128918 /nfs/dbraw/zinc/12/89/18/1062128918.db2.gz CLICOZPETCFTLE-LLVKDONJSA-N 0 3 316.323 4.236 20 5 DIBDHN Cc1ccc2cc(CN(C)CCc3ccccc3[N+](=O)[O-])[nH]c2c1 ZINC001474516279 1062202420 /nfs/dbraw/zinc/20/24/20/1062202420.db2.gz HHBQBRNKKISLFG-UHFFFAOYSA-N 0 3 323.396 4.059 20 5 DIBDHN Cc1ccc(CN2CCSC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC001459626638 1062263088 /nfs/dbraw/zinc/26/30/88/1062263088.db2.gz ANBIOERZWVQRSG-UHFFFAOYSA-N 0 3 320.458 4.155 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC2(C1)CCCCC2 ZINC001474567634 1062271178 /nfs/dbraw/zinc/27/11/78/1062271178.db2.gz OBPWHTPXEJZCRA-XNTDXEJSSA-N 0 3 300.402 4.264 20 5 DIBDHN Cc1ccc([C@H](C)NCc2cccc3ncccc23)cc1[N+](=O)[O-] ZINC001459825081 1062428965 /nfs/dbraw/zinc/42/89/65/1062428965.db2.gz OFXRZJYCQZYFLG-AWEZNQCLSA-N 0 3 321.380 4.302 20 5 DIBDHN CC1(C)CCC[C@H]1[C@@H]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC001460295344 1062765589 /nfs/dbraw/zinc/76/55/89/1062765589.db2.gz IKKMDUDRZFVEOY-CJNGLKHVSA-N 0 3 320.408 4.382 20 5 DIBDHN O=[N+]([O-])c1cccc(F)c1CN1CCC[C@@H]1CC1CCCC1 ZINC001460317915 1062774844 /nfs/dbraw/zinc/77/48/44/1062774844.db2.gz UJNSXAQKKAYSQW-CQSZACIVSA-N 0 3 306.381 4.279 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)CCC[C@H]1C ZINC001307478091 1065425653 /nfs/dbraw/zinc/42/56/53/1065425653.db2.gz ISEUSHLTDYFNAB-LSDHHAIUSA-N 0 3 320.433 4.393 20 5 DIBDHN CCCCC[C@H]1CCCN1Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC001307580129 1065493618 /nfs/dbraw/zinc/49/36/18/1065493618.db2.gz AZTKBCQLAFFXDV-HNNXBMFYSA-N 0 3 306.406 4.148 20 5 DIBDHN CC[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H]1C ZINC001307703642 1065573346 /nfs/dbraw/zinc/57/33/46/1065573346.db2.gz WRKMWQOYPSDKNY-KBPBESRZSA-N 0 3 306.406 4.002 20 5 DIBDHN C[C@H](c1ccccc1Cl)N(C)CCc1ccccc1[N+](=O)[O-] ZINC001307759768 1065609608 /nfs/dbraw/zinc/60/96/08/1065609608.db2.gz CTJHREOSFTVNGM-CYBMUJFWSA-N 0 3 318.804 4.484 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C1CCC1)C1CCC1 ZINC001307810402 1065633898 /nfs/dbraw/zinc/63/38/98/1065633898.db2.gz KCOTXDJHVIJVEA-UHFFFAOYSA-N 0 3 318.417 4.289 20 5 DIBDHN CC1(C)[C@@H](c2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC001307854851 1065654236 /nfs/dbraw/zinc/65/42/36/1065654236.db2.gz KNORXIQXDBMYDM-OAHLLOKOSA-N 0 3 316.426 4.424 20 5 DIBDHN CC1(C)[C@H](c2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC001307854850 1065654408 /nfs/dbraw/zinc/65/44/08/1065654408.db2.gz KNORXIQXDBMYDM-HNNXBMFYSA-N 0 3 316.426 4.424 20 5 DIBDHN CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1[O-] ZINC000903286751 1066100899 /nfs/dbraw/zinc/10/08/99/1066100899.db2.gz GDUCWWIDLNBSFG-WBMJQRKESA-N 0 3 300.358 4.102 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CC([C@@H]2CCC[C@@H](C)C2)C1 ZINC001308911071 1066389890 /nfs/dbraw/zinc/38/98/90/1066389890.db2.gz DAEVDCFIUFAKJI-CZUORRHYSA-N 0 3 316.445 4.470 20 5 DIBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000035055417 331467675 /nfs/dbraw/zinc/46/76/75/331467675.db2.gz SOQQIAJPHOZGNZ-INIZCTEOSA-N 0 3 304.777 4.489 20 5 DIBDHN Cc1[nH]c2c(cc(C)cc2CNCc2ccc([N+](=O)[O-])cc2)c1C ZINC000557407900 331788701 /nfs/dbraw/zinc/78/87/01/331788701.db2.gz TWYYQQVDCLELAH-UHFFFAOYSA-N 0 3 323.396 4.291 20 5 DIBDHN O=[N+]([O-])c1cccc(-c2ccc(CNCCc3ccccc3)o2)c1 ZINC000409638767 332041620 /nfs/dbraw/zinc/04/16/20/332041620.db2.gz NXGZTLPPLRQJQA-UHFFFAOYSA-N 0 3 322.364 4.187 20 5 DIBDHN O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CCC[C@H]2F)s1 ZINC000559359055 332128076 /nfs/dbraw/zinc/12/80/76/332128076.db2.gz ODXNDJZLHVQGMV-KGLIPLIRSA-N 0 3 320.389 4.304 20 5 DIBDHN CCC[C@H](NCC1(C(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000560583946 332365226 /nfs/dbraw/zinc/36/52/26/332365226.db2.gz DLIZHDDGTLRVNZ-ZDUSSCGKSA-N 0 3 316.323 4.368 20 5 DIBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1C)c1ccc(OC)cc1 ZINC000181828521 333032841 /nfs/dbraw/zinc/03/28/41/333032841.db2.gz XDYYNQVBXOEVRI-KRWDZBQOSA-N 0 3 314.385 4.153 20 5 DIBDHN O=[N+]([O-])c1ccc(CNC2CC(c3ccccc3Cl)C2)cc1 ZINC000378878835 333059248 /nfs/dbraw/zinc/05/92/48/333059248.db2.gz DIERDIWGLXAYPT-UHFFFAOYSA-N 0 3 316.788 4.284 20 5 DIBDHN Cc1c(CN[C@H](C)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000048334970 333587271 /nfs/dbraw/zinc/58/72/71/333587271.db2.gz WGXURXTYWFHETH-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN COc1cccc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000268783038 333994247 /nfs/dbraw/zinc/99/42/47/333994247.db2.gz JFXJOZBRTDLGJZ-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000438472387 334116902 /nfs/dbraw/zinc/11/69/02/334116902.db2.gz XSNVHMYHNPEOIT-VGVVRCBHSA-N 0 3 316.323 4.175 20 5 DIBDHN Cc1cc([C@@H](C)NCc2cccc([N+](=O)[O-])c2C)c(C)s1 ZINC000049507058 334342967 /nfs/dbraw/zinc/34/29/67/334342967.db2.gz ZKYOFYWBFJBQMY-GFCCVEGCSA-N 0 3 304.415 4.432 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CN[C@@H]1CCCc2sccc21 ZINC000341558897 334452212 /nfs/dbraw/zinc/45/22/12/334452212.db2.gz FKBRLMYLBUEVBS-ZDTYVGOBSA-N 0 3 314.410 4.337 20 5 DIBDHN C[C@@H](N[C@@H](c1cccs1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000051100073 334735883 /nfs/dbraw/zinc/73/58/83/334735883.db2.gz BEDMVXRHUOBZNB-BDJLRTHQSA-N 0 3 302.399 4.458 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CCCC(F)(F)C1)CCC2 ZINC000332252445 336165125 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CCC[C@H](NCc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120134602 337869094 /nfs/dbraw/zinc/86/90/94/337869094.db2.gz SMRPODBWIXJTOC-SFHVURJKSA-N 0 3 314.385 4.234 20 5 DIBDHN CC[C@@H](CSc1ccccc1[N+](=O)[O-])NCc1occc1C ZINC000426340309 338027834 /nfs/dbraw/zinc/02/78/34/338027834.db2.gz ZQFQQBRBXCFCAB-ZDUSSCGKSA-N 0 3 320.414 4.157 20 5 DIBDHN CC1(C)C[C@@H](NCc2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000433124456 338182445 /nfs/dbraw/zinc/18/24/45/338182445.db2.gz CNABZMSSJKPPRL-QGZVFWFLSA-N 0 3 314.360 4.246 20 5 DIBDHN Cc1ccsc1CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433155195 338183311 /nfs/dbraw/zinc/18/33/11/338183311.db2.gz WWXQDOKQEJKQAI-HNNXBMFYSA-N 0 3 316.426 4.477 20 5 DIBDHN C[C@H]1[C@H](c2ccccc2)CCN1Cc1c(F)cccc1[N+](=O)[O-] ZINC000434900332 338227273 /nfs/dbraw/zinc/22/72/73/338227273.db2.gz CWHJGZXJUHUNEX-DZGCQCFKSA-N 0 3 314.360 4.112 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H]1C[C@H](c2ccccc2F)C1 ZINC000435779197 338248709 /nfs/dbraw/zinc/24/87/09/338248709.db2.gz 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ZINC000467846444 339247494 /nfs/dbraw/zinc/24/74/94/339247494.db2.gz NKCZBHALXAHRHN-CQSZACIVSA-N 0 3 321.380 4.036 20 5 DIBDHN Cc1cccc(O[C@@H](C)CN[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000467851218 339247627 /nfs/dbraw/zinc/24/76/27/339247627.db2.gz BLEKMGDQAVXKHV-GJZGRUSLSA-N 0 3 314.385 4.021 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(F)c(Cl)c1 ZINC000467969936 339250230 /nfs/dbraw/zinc/25/02/30/339250230.db2.gz OAXBCGZSMCBNRY-LLVKDONJSA-N 0 3 322.767 4.281 20 5 DIBDHN C[C@@H](NCCc1ccccc1[N+](=O)[O-])c1ccc(F)cc1Cl ZINC000468006465 339250956 /nfs/dbraw/zinc/25/09/56/339250956.db2.gz RMMQBRUMHFKQBL-LLVKDONJSA-N 0 3 322.767 4.281 20 5 DIBDHN CCS[C@@H]1CCCCN([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000468229970 339256847 /nfs/dbraw/zinc/25/68/47/339256847.db2.gz JKFYTNXDIMGOAI-UONOGXRCSA-N 0 3 308.447 4.263 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@H](C(F)(F)F)C1(C)C ZINC000470140626 339311642 /nfs/dbraw/zinc/31/16/42/339311642.db2.gz GPMSKNRPYLOGSB-CYBMUJFWSA-N 0 3 316.323 4.066 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CCCO[C@H]1CCCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000245530282 520288095 /nfs/dbraw/zinc/28/80/95/520288095.db2.gz SIQCBHRAQJBUHH-WBVHZDCISA-N 0 3 320.433 4.245 20 5 DIBDHN O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@@H]1C1CCCC1 ZINC000609705317 1036027838 /nfs/dbraw/zinc/02/78/38/1036027838.db2.gz UIJMJDXWIUSGCN-OAHLLOKOSA-N 0 3 308.809 4.403 20 5 DIBDHN Cc1csc([C@H](C)NCCCCc2ccc([N+](=O)[O-])cc2)n1 ZINC000599033575 1036456417 /nfs/dbraw/zinc/45/64/17/1036456417.db2.gz WUTUMJKYCXBMTC-ZDUSSCGKSA-N 0 3 319.430 4.033 20 5 DIBDHN O=[N+]([O-])c1ccc(CNCc2cccc(CC3CCC3)c2)cc1 ZINC001648882195 1036670569 /nfs/dbraw/zinc/67/05/69/1036670569.db2.gz ARWQNUMHYGEWEB-UHFFFAOYSA-N 0 3 310.397 4.227 20 5 DIBDHN CC[C@@H]1CC[C@H](C)N1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000537853145 1037358073 /nfs/dbraw/zinc/35/80/73/1037358073.db2.gz WFYGAMCVUOUOOJ-SWLSCSKDSA-N 0 3 315.373 4.013 20 5 DIBDHN CCC1CCC(N(C)Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000610580953 1037640357 /nfs/dbraw/zinc/64/03/57/1037640357.db2.gz LQCRAGRTFDQHSY-UHFFFAOYSA-N 0 3 317.389 4.137 20 5 DIBDHN CC[C@H](C)[C@@H]1CCCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610582171 1038200297 /nfs/dbraw/zinc/20/02/97/1038200297.db2.gz FMNRXWVGYZTTOT-WFASDCNBSA-N 0 3 317.389 4.137 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C/CN[C@@H](c1ccccn1)C1CCC1 ZINC000598994170 1038210855 /nfs/dbraw/zinc/21/08/55/1038210855.db2.gz WVTYIZZEGCUGIQ-ZAOIQFLMSA-N 0 3 323.396 4.134 20 5 DIBDHN COc1ccc([C@H](C)N(C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000603837508 1038293188 /nfs/dbraw/zinc/29/31/88/1038293188.db2.gz NZKPYRWCFHLWSV-AWEZNQCLSA-N 0 3 314.385 4.105 20 5 DIBDHN CC(C)[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000061558018 1038408253 /nfs/dbraw/zinc/40/82/53/1038408253.db2.gz NUZNKHZJEWDLRR-QGZVFWFLSA-N 0 3 302.349 4.221 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccc(C(F)F)cc1 ZINC000582191544 1038609112 /nfs/dbraw/zinc/60/91/12/1038609112.db2.gz AZCKPXSVFPIIPE-OAHLLOKOSA-N 0 3 318.323 4.310 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN3CC=CCC3)s2)cc1 ZINC000611521129 1038774714 /nfs/dbraw/zinc/77/47/14/1038774714.db2.gz CKCYAKHBCVOHGU-UHFFFAOYSA-N 0 3 300.383 4.085 20 5 DIBDHN CCOc1cccc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178651326 1038848416 /nfs/dbraw/zinc/84/84/16/1038848416.db2.gz PLAQSKLGORRNNW-KGLIPLIRSA-N 0 3 314.385 4.405 20 5 DIBDHN Cc1c(CN[C@@H]2CCCc3sccc32)cccc1[N+](=O)[O-] ZINC000061362320 1039046140 /nfs/dbraw/zinc/04/61/40/1039046140.db2.gz SWXVFUAOPDQEKF-CQSZACIVSA-N 0 3 302.399 4.132 20 5 DIBDHN COc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1C ZINC000161792980 1039395693 /nfs/dbraw/zinc/39/56/93/1039395693.db2.gz BLDVNIJIHHASRZ-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN O=[N+]([O-])c1ccccc1/C=C\CNC1(c2ccc(F)cc2)CC1 ZINC000540608346 1039528677 /nfs/dbraw/zinc/52/86/77/1039528677.db2.gz UUVWFGLPGNXEIW-HYXAFXHYSA-N 0 3 312.344 4.026 20 5 DIBDHN CC[C@H](N[C@@H]1CCc2ccc(F)cc21)c1cccc([N+](=O)[O-])c1 ZINC000090068583 1039591619 /nfs/dbraw/zinc/59/16/19/1039591619.db2.gz DGWNSMQMAQVEAY-ZWKOTPCHSA-N 0 3 314.360 4.462 20 5 DIBDHN C[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000609147440 1039818528 /nfs/dbraw/zinc/81/85/28/1039818528.db2.gz UPUZOLAPJNSTLH-WWGRRREGSA-N 0 3 306.381 4.135 20 5 DIBDHN CCOc1cc(CN[C@H](CC)c2cccs2)ccc1[N+](=O)[O-] ZINC000491598803 1039864033 /nfs/dbraw/zinc/86/40/33/1039864033.db2.gz KRZRIHFLLLTRIG-CYBMUJFWSA-N 0 3 320.414 4.296 20 5 DIBDHN CCSc1cccc(CNCc2ccc([N+](=O)[O-])cc2C)c1 ZINC000492401088 1039959448 /nfs/dbraw/zinc/95/94/48/1039959448.db2.gz UTBHNCVRQNZCGX-UHFFFAOYSA-N 0 3 316.426 4.305 20 5 DIBDHN O=[N+]([O-])c1cccc(CN(C2CC2)[C@@H]2CCc3ccccc32)c1 ZINC000065951541 1040618920 /nfs/dbraw/zinc/61/89/20/1040618920.db2.gz OHNNWOBYTFXVIF-LJQANCHMSA-N 0 3 308.381 4.247 20 5 DIBDHN C[C@H](N[C@@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000173361522 1040886201 /nfs/dbraw/zinc/88/62/01/1040886201.db2.gz NOPFVJMWJMOQSM-APPDUMDISA-N 0 3 300.333 4.072 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000093116049 1041876598 /nfs/dbraw/zinc/87/65/98/1041876598.db2.gz JYHIHVFTVDCVFT-QGZVFWFLSA-N 0 3 314.360 4.210 20 5 DIBDHN C[C@H](N[C@H](c1cccs1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555728 1041962565 /nfs/dbraw/zinc/96/25/65/1041962565.db2.gz GUHYFHPUDGEJCX-QFYYESIMSA-N 0 3 317.414 4.040 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1F ZINC000815587884 1041968481 /nfs/dbraw/zinc/96/84/81/1041968481.db2.gz WTDOKRICAYKOFF-NEPJUHHUSA-N 0 3 317.364 4.036 20 5 DIBDHN CC(C)c1cccc(CN[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815617944 1041975156 /nfs/dbraw/zinc/97/51/56/1041975156.db2.gz YZKBIYCSKNPMBK-ZDUSSCGKSA-N 0 3 313.401 4.151 20 5 DIBDHN COc1ccc(CN(C)[C@@H](C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000515777017 1042835042 /nfs/dbraw/zinc/83/50/42/1042835042.db2.gz VTXHYPWKCSNQFQ-AWEZNQCLSA-N 0 3 314.385 4.105 20 5 DIBDHN Cc1ccc(CN[C@H](c2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000108423122 1042911460 /nfs/dbraw/zinc/91/14/60/1042911460.db2.gz AXNXCSARCXHTIE-SFHVURJKSA-N 0 3 314.360 4.283 20 5 DIBDHN C[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441490045 1043182414 /nfs/dbraw/zinc/18/24/14/1043182414.db2.gz VJVKKZFKJCHAHN-TYNCELHUSA-N 0 3 308.809 4.401 20 5 DIBDHN CN(Cc1ccc([N+](=O)[O-])cc1Cl)C1CCC(F)(F)CC1 ZINC000558181868 1043453053 /nfs/dbraw/zinc/45/30/53/1043453053.db2.gz UDZDIBPUNKJXHR-UHFFFAOYSA-N 0 3 318.751 4.258 20 5 DIBDHN C[C@H](NCC[C@@]1(C)C[C@]1(F)Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872084477 1043453480 /nfs/dbraw/zinc/45/34/80/1043453480.db2.gz SJRHBIGUISWFFF-QCZZGDTMSA-N 0 3 318.751 4.089 20 5 DIBDHN COc1cccc([C@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000267470471 1043577599 /nfs/dbraw/zinc/57/75/99/1043577599.db2.gz XQDJCTVAWKVYED-STQMWFEESA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@H](CN(C)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000522549681 1044043453 /nfs/dbraw/zinc/04/34/53/1044043453.db2.gz FYSIDKCTQKGGMZ-CYBMUJFWSA-N 0 3 318.804 4.484 20 5 DIBDHN C[C@H](N[C@@H](C)c1ccc2c(c1)COC2)c1ccc([N+](=O)[O-])cc1 ZINC000296230542 1044600170 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DIBDHN CCc1cnccc1[C@H](C)N[C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000579270048 1045303667 /nfs/dbraw/zinc/30/36/67/1045303667.db2.gz MNHQMGFDULUJIG-KBPBESRZSA-N 0 3 313.401 4.272 20 5 DIBDHN Cc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000449347903 1045380197 /nfs/dbraw/zinc/38/01/97/1045380197.db2.gz JQISUJCQOJJUID-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1Cc1cccc([N+](=O)[O-])c1 ZINC000449365726 1045382306 /nfs/dbraw/zinc/38/23/06/1045382306.db2.gz UUPLXNPGENUUPX-DMDPSCGWSA-N 0 3 316.323 4.146 20 5 DIBDHN O=[N+]([O-])c1cccc(CN2CCC(c3ccc(F)cc3)CC2)c1 ZINC000752094085 1045658678 /nfs/dbraw/zinc/65/86/78/1045658678.db2.gz VBJMWIJGYZEHOE-UHFFFAOYSA-N 0 3 314.360 4.114 20 5 DIBDHN C[C@H]1C[C@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801517290 1045728186 /nfs/dbraw/zinc/72/81/86/1045728186.db2.gz LZBNLSIIUCXQDH-BBRMVZONSA-N 0 3 314.360 4.112 20 5 DIBDHN CC[C@](C)(NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000801529770 1045730553 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DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H](c1ccncc1)C1CC1 ZINC000903430059 1046279763 /nfs/dbraw/zinc/27/97/63/1046279763.db2.gz XJCXSUCWKMNNKL-UGSOOPFHSA-N 0 3 311.385 4.100 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(Cc2ccco2)C2CCCC2)cc1 ZINC000052077134 1046360274 /nfs/dbraw/zinc/36/02/74/1046360274.db2.gz ZBWVRYMWKAJEIV-UHFFFAOYSA-N 0 3 300.358 4.133 20 5 DIBDHN CC(C)c1cnc(CNC[C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000897465797 1046440327 /nfs/dbraw/zinc/44/03/27/1046440327.db2.gz IKILGTNPQUMQAV-LBPRGKRZSA-N 0 3 319.430 4.068 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@H](C)c1cccc(Cl)c1 ZINC000486717725 1046468448 /nfs/dbraw/zinc/46/84/48/1046468448.db2.gz RIUDRRQFRVFVFQ-GFCCVEGCSA-N 0 3 304.777 4.407 20 5 DIBDHN CC[C@H](CC(F)(F)F)NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783674964 1046621348 /nfs/dbraw/zinc/62/13/48/1046621348.db2.gz SOPVMJOOZQITHH-SECBINFHSA-N 0 3 310.703 4.069 20 5 DIBDHN Cc1cccc(C2(NCc3ccccc3[N+](=O)[O-])CCCC2)c1 ZINC000533510579 1046739256 /nfs/dbraw/zinc/73/92/56/1046739256.db2.gz WFJFSVBKLAJFQT-UHFFFAOYSA-N 0 3 310.397 4.462 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1c2ccccc2C[C@@H]1C ZINC000536873425 1047116916 /nfs/dbraw/zinc/11/69/16/1047116916.db2.gz ZYOUNLPHKSXSAU-CKFHNAJUSA-N 0 3 310.397 4.487 20 5 DIBDHN CCOc1ccc([C@H](C)NCc2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000152573310 1047256051 /nfs/dbraw/zinc/25/60/51/1047256051.db2.gz XBNPORACPWJDIJ-AWEZNQCLSA-N 0 3 314.385 4.153 20 5 DIBDHN O=C1CCN(Cc2c3ccccc3cc3ccccc32)CC[C@@H]1F ZINC001141723415 1047278807 /nfs/dbraw/zinc/27/88/07/1047278807.db2.gz WUFRFPHETBGDAB-FQEVSTJZSA-N 0 3 321.395 4.496 20 5 DIBDHN CCc1cnccc1[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000538113255 1047658494 /nfs/dbraw/zinc/65/84/94/1047658494.db2.gz BRYGBKFWLFEDOQ-UONOGXRCSA-N 0 3 313.401 4.272 20 5 DIBDHN C[C@H](N[C@@H]1CCSC2(CCC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000927035435 1047765797 /nfs/dbraw/zinc/76/57/97/1047765797.db2.gz GPIRTKRTLCGXMF-NWDGAFQWSA-N 0 3 324.421 4.203 20 5 DIBDHN Cc1c(CN[C@H]2c3cc(F)ccc3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000478510804 1047791915 /nfs/dbraw/zinc/79/19/15/1047791915.db2.gz ZGBWFZZZVYZUCK-BBATYDOGSA-N 0 3 314.360 4.065 20 5 DIBDHN C[C@@H](COCC1CCCCC1)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001198000663 1047912174 /nfs/dbraw/zinc/91/21/74/1047912174.db2.gz IQYOZCKCQXWWPD-GJZGRUSLSA-N 0 3 320.433 4.231 20 5 DIBDHN C[C@H](N[C@H]1C[C@@H](OC(C)(C)C)C1(C)C)c1ccccc1[N+](=O)[O-] ZINC001183651450 1047950959 /nfs/dbraw/zinc/95/09/59/1047950959.db2.gz DTXMYANKQWHEQO-VBNZEHGJSA-N 0 3 320.433 4.228 20 5 DIBDHN C[C@H](N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C)c1ccccc1[N+](=O)[O-] ZINC001183651448 1047952248 /nfs/dbraw/zinc/95/22/48/1047952248.db2.gz DTXMYANKQWHEQO-MAZHCROVSA-N 0 3 320.433 4.228 20 5 DIBDHN CC(C)P(CCNc1ncc([N+](=O)[O-])cc1Cl)C(C)C ZINC001162357870 1048266087 /nfs/dbraw/zinc/26/60/87/1048266087.db2.gz OOYUAEPEYJBSHZ-UHFFFAOYSA-N 0 3 317.757 4.354 20 5 DIBDHN CC(C)P(CCNc1ncc(Cl)cc1[N+](=O)[O-])C(C)C ZINC001162357359 1048266120 /nfs/dbraw/zinc/26/61/20/1048266120.db2.gz IWYMUROKBZWNLP-UHFFFAOYSA-N 0 3 317.757 4.354 20 5 DIBDHN CCOc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000481543126 1048429382 /nfs/dbraw/zinc/42/93/82/1048429382.db2.gz KEOFKYITHKSCPG-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN C[C@H](N[C@@H](C)c1ccc2c(c1)CCC2)c1ccc([N+](=O)[O-])cc1 ZINC001176036361 1048540625 /nfs/dbraw/zinc/54/06/25/1048540625.db2.gz KNHWSTCVZMSAQY-KBPBESRZSA-N 0 3 310.397 4.495 20 5 DIBDHN CCCCN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC001190348187 1048721447 /nfs/dbraw/zinc/72/14/47/1048721447.db2.gz IUDAIZJUZLEADZ-UHFFFAOYSA-N 0 3 316.323 4.378 20 5 DIBDHN Cc1ccc(CNCc2cc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC001177728889 1048933420 /nfs/dbraw/zinc/93/34/20/1048933420.db2.gz AIBKJIACYYKZPC-UHFFFAOYSA-N 0 3 316.426 4.133 20 5 DIBDHN CCC[C@H](C)[C@H]1CCCN1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001192173988 1049053894 /nfs/dbraw/zinc/05/38/94/1049053894.db2.gz NPNBACQFZOTYFL-SWLSCSKDSA-N 0 3 324.396 4.143 20 5 DIBDHN CCOc1cccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173364223 1049140263 /nfs/dbraw/zinc/14/02/63/1049140263.db2.gz RHTZSIOSHMDZEP-ZIAGYGMSSA-N 0 3 314.385 4.405 20 5 DIBDHN CCC[C@H](C)N(C)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001204890500 1049301053 /nfs/dbraw/zinc/30/10/53/1049301053.db2.gz NYAGRHDGNKHMGN-JTQLQIEISA-N 0 3 304.312 4.234 20 5 DIBDHN COc1cc(CN(C)[C@H](C)c2ccc(C)cc2)ccc1[N+](=O)[O-] ZINC000485713808 1049323150 /nfs/dbraw/zinc/32/31/50/1049323150.db2.gz DDSFNCIRUPQKSY-CQSZACIVSA-N 0 3 314.385 4.105 20 5 DIBDHN CCCCOC1CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000490085715 1049801987 /nfs/dbraw/zinc/80/19/87/1049801987.db2.gz KJUKXXXNNWAGQK-OAHLLOKOSA-N 0 3 320.433 4.245 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@]2(CC2(F)F)C1 ZINC000844441401 1050427329 /nfs/dbraw/zinc/42/73/29/1050427329.db2.gz MRLKCSHFHJGCIJ-IUODEOHRSA-N 0 3 310.344 4.085 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H]1CCCc2ccccc21 ZINC000594492320 1050517074 /nfs/dbraw/zinc/51/70/74/1050517074.db2.gz NLPKPHKXGJESLJ-QZTJIDSGSA-N 0 3 308.381 4.249 20 5 DIBDHN Cc1ccc2c(c1)[C@@H](N[C@H]1CCc3c1cccc3[N+](=O)[O-])CC2 ZINC000594501001 1050521171 /nfs/dbraw/zinc/52/11/71/1050521171.db2.gz CLZVDLJGAAOZFK-ROUUACIJSA-N 0 3 308.381 4.168 20 5 DIBDHN Cc1ccc(C[C@@H](C)N(C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000738330060 1050531972 /nfs/dbraw/zinc/53/19/72/1050531972.db2.gz GALJEMISIAQXCZ-CQSZACIVSA-N 0 3 316.376 4.105 20 5 DIBDHN C[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]2CCCC[C@H]21 ZINC001168405680 1050553774 /nfs/dbraw/zinc/55/37/74/1050553774.db2.gz ZPWQNYAIEYLEGB-BYCMXARLSA-N 0 3 308.809 4.259 20 5 DIBDHN C[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC001168405681 1050555181 /nfs/dbraw/zinc/55/51/81/1050555181.db2.gz ZPWQNYAIEYLEGB-DFBGVHRSSA-N 0 3 308.809 4.259 20 5 DIBDHN CSc1cccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000595417693 1050631084 /nfs/dbraw/zinc/63/10/84/1050631084.db2.gz YHBBSODYANIVIQ-GFCCVEGCSA-N 0 3 302.399 4.168 20 5 DIBDHN C[C@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788496700 1050693214 /nfs/dbraw/zinc/69/32/14/1050693214.db2.gz AOKNYUFQOQIGKT-QWRGUYRKSA-N 0 3 319.792 4.242 20 5 DIBDHN CC(C)c1ccc(CN[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788563207 1050703938 /nfs/dbraw/zinc/70/39/38/1050703938.db2.gz OOIDQOJIDJHVEL-CYBMUJFWSA-N 0 3 313.401 4.151 20 5 DIBDHN Cc1cc([C@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)s1 ZINC000788693309 1050727928 /nfs/dbraw/zinc/72/79/28/1050727928.db2.gz RSJQIJXGLHCMAH-QWRGUYRKSA-N 0 3 319.430 4.267 20 5 DIBDHN Cc1cc([C@@H](C)N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)s1 ZINC000788693307 1050728125 /nfs/dbraw/zinc/72/81/25/1050728125.db2.gz RSJQIJXGLHCMAH-GHMZBOCLSA-N 0 3 319.430 4.267 20 5 DIBDHN CC[C@H](NCc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000036921214 1051101961 /nfs/dbraw/zinc/10/19/61/1051101961.db2.gz HFVHKAUNJGNXLH-INIZCTEOSA-N 0 3 304.777 4.489 20 5 DIBDHN O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC1(C2CCC2)CC1 ZINC001171693940 1051205125 /nfs/dbraw/zinc/20/51/25/1051205125.db2.gz PYLVDPAGYFMTER-UHFFFAOYSA-N 0 3 315.200 4.324 20 5 DIBDHN C[C@H]1Cc2ccccc2[C@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522477 1051585066 /nfs/dbraw/zinc/58/50/66/1051585066.db2.gz ZCUODFGLUNDYPH-GTNSWQLSSA-N 0 3 316.788 4.271 20 5 DIBDHN CCSCC[C@H](C)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768548962 1051944412 /nfs/dbraw/zinc/94/44/12/1051944412.db2.gz MTJKFXRGZHNABW-NSHDSACASA-N 0 3 316.854 4.212 20 5 DIBDHN F[C@@H]1CNCC[C@@H]1OCc1c2ccccc2cc2ccccc21 ZINC001217796324 1052144887 /nfs/dbraw/zinc/14/48/87/1052144887.db2.gz YQMMEMYEHFKPGL-UXHICEINSA-N 0 3 309.384 4.210 20 5 DIBDHN CC[C@@H](N[C@@H](C)c1sc(C)nc1C)c1cccc([N+](=O)[O-])c1 ZINC000194384466 1052538657 /nfs/dbraw/zinc/53/86/57/1052538657.db2.gz HVMUQXJRQYNQLF-XHDPSFHLSA-N 0 3 319.430 4.470 20 5 DIBDHN Cc1c([C@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)cccc1[N+](=O)[O-] ZINC000556921041 1052900730 /nfs/dbraw/zinc/90/07/30/1052900730.db2.gz LTUWOLNUNIOVNI-STQMWFEESA-N 0 3 324.384 4.191 20 5 DIBDHN COc1ccc(CN2CCCC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000609541426 1052981766 /nfs/dbraw/zinc/98/17/66/1052981766.db2.gz QNYNZNZSAJLGBJ-UHFFFAOYSA-N 0 3 318.417 4.150 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H]1CCc3ccccc31)CCC2 ZINC000618562198 1053323304 /nfs/dbraw/zinc/32/33/04/1053323304.db2.gz HXJPFVYXYCHWTB-MOPGFXCFSA-N 0 3 308.381 4.249 20 5 DIBDHN Cc1ccncc1[C@H](C)N[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571384 1053325282 /nfs/dbraw/zinc/32/52/82/1053325282.db2.gz HEQSBXAURNXGSZ-UGSOOPFHSA-N 0 3 311.385 4.026 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN(CCC(F)(F)F)CC1CC1 ZINC000183391802 1053649732 /nfs/dbraw/zinc/64/97/32/1053649732.db2.gz YNXAZAQTJSWIQA-UHFFFAOYSA-N 0 3 316.323 4.068 20 5 DIBDHN Cc1ccc([C@@H](C)NC/C=C\c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC001200810693 1053997898 /nfs/dbraw/zinc/99/78/98/1053997898.db2.gz AAMYRGILJFACSN-VQTKUKTRSA-N 0 3 314.360 4.406 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000848526944 1054127618 /nfs/dbraw/zinc/12/76/18/1054127618.db2.gz MNWJLWLKAKDJPH-BXUZGUMPSA-N 0 3 302.399 4.303 20 5 DIBDHN CC(C)(NCc1ccc2c(c1)CCC2)c1ccc([N+](=O)[O-])cc1 ZINC001337942044 1054293746 /nfs/dbraw/zinc/29/37/46/1054293746.db2.gz LPVIXUGGNJFFNP-UHFFFAOYSA-N 0 3 310.397 4.108 20 5 DIBDHN Cc1ccc([C@@H](C)NCc2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC001168553536 1055569679 /nfs/dbraw/zinc/56/96/79/1055569679.db2.gz UBVCTQQJEQHYEN-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN C[C@@H](N[C@H]1CCCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000090964131 1056123716 /nfs/dbraw/zinc/12/37/16/1056123716.db2.gz NZFMMCXMVMHULQ-XIKOKIGWSA-N 0 3 314.360 4.462 20 5 DIBDHN C[C@H]1[C@H](c2ccccc2)CCN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001615804485 1056578511 /nfs/dbraw/zinc/57/85/11/1056578511.db2.gz DTOUCILLYKKXSM-SUMWQHHRSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)C ZINC000113342170 1056714746 /nfs/dbraw/zinc/71/47/46/1056714746.db2.gz ZKZJHOAHVXKHLG-LLVKDONJSA-N 0 3 319.430 4.243 20 5 DIBDHN C[C@@H](N[C@@H](C)c1ccc2c(c1)CCC2)c1cccc([N+](=O)[O-])c1 ZINC000390856934 1057051340 /nfs/dbraw/zinc/05/13/40/1057051340.db2.gz ADDPHCGHHQDQNK-KGLIPLIRSA-N 0 3 310.397 4.495 20 5 DIBDHN CCc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)s1 ZINC000156289291 1057076752 /nfs/dbraw/zinc/07/67/52/1057076752.db2.gz IXXKPZWXPRQBHS-GFCCVEGCSA-N 0 3 304.415 4.378 20 5 DIBDHN C[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000173361536 1057295451 /nfs/dbraw/zinc/29/54/51/1057295451.db2.gz NOPFVJMWJMOQSM-PIGZYNQJSA-N 0 3 300.333 4.072 20 5 DIBDHN C[C@@H]1CCC[C@H](CCN2CCc3ccc([N+](=O)[O-])cc3C2)C1 ZINC001559595111 1059428533 /nfs/dbraw/zinc/42/85/33/1059428533.db2.gz YSZIULCOKWAMOO-HUUCEWRRSA-N 0 3 302.418 4.169 20 5 DIBDHN COc1cc([N+](=O)[O-])ccc1CN(C)C1CCC(C)(C)CC1 ZINC001559595380 1059428802 /nfs/dbraw/zinc/42/88/02/1059428802.db2.gz CUENJJCSOOKCJT-UHFFFAOYSA-N 0 3 306.406 4.004 20 5 DIBDHN c1ccc2c(c1)cc(-c1noc([C@H]3CCCN3)n1)c1ccccc21 ZINC001247497490 1059503010 /nfs/dbraw/zinc/50/30/10/1059503010.db2.gz KEPWQMBOWLIURF-GOSISDBHSA-N 0 3 315.376 4.468 20 5 DIBDHN O=[N+]([O-])c1ccc(CN(C[C@H]2CCCCC2(F)F)C2CC2)cc1 ZINC001559713291 1059540975 /nfs/dbraw/zinc/54/09/75/1059540975.db2.gz LVMGRJALLVCTKF-CQSZACIVSA-N 0 3 324.371 4.385 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCCC[C@@H]2CC2CCC2)c(F)c1 ZINC001560017941 1059830459 /nfs/dbraw/zinc/83/04/59/1059830459.db2.gz ZELXWNMTWVECNV-OAHLLOKOSA-N 0 3 306.381 4.279 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCC[C@@H](C2CCC2)CC1 ZINC001560091409 1059904121 /nfs/dbraw/zinc/90/41/21/1059904121.db2.gz IYCVFFXCUMRJBB-CQSZACIVSA-N 0 3 306.381 4.136 20 5 DIBDHN CS[C@H](CNCc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC001560752389 1060618215 /nfs/dbraw/zinc/61/82/15/1060618215.db2.gz CQCAVRNPKGTHEJ-CYBMUJFWSA-N 0 3 316.854 4.116 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCc2cc(C)ccc2C1 ZINC001560894862 1060756094 /nfs/dbraw/zinc/75/60/94/1060756094.db2.gz WYVDRAJXBXXSGU-YBEGLDIGSA-N 0 3 322.408 4.365 20 5 DIBDHN O=[N+]([O-])c1cccc(CN2C[C@@H]3CCCC[C@@]32c2ccccc2)c1 ZINC001473229541 1061009812 /nfs/dbraw/zinc/00/98/12/1061009812.db2.gz ANCYWTJFJDJUPM-AZUAARDMSA-N 0 3 322.408 4.496 20 5 DIBDHN CCO[C@@H]1C[C@@H](N(C)Cc2ccccc2[N+](=O)[O-])C1(CC)CC ZINC001473243448 1061018800 /nfs/dbraw/zinc/01/88/00/1061018800.db2.gz KANSHPYGIORPIY-IAGOWNOFSA-N 0 3 320.433 4.010 20 5 DIBDHN C[C@@H](N[C@H]1C[C@@H](OC(C)(C)C)C1(C)C)c1ccccc1[N+](=O)[O-] ZINC001473541497 1061233590 /nfs/dbraw/zinc/23/35/90/1061233590.db2.gz DTXMYANKQWHEQO-UHOFOFEASA-N 0 3 320.433 4.228 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCC[C@H]1CC1CCCC1 ZINC001473595862 1061280285 /nfs/dbraw/zinc/28/02/85/1061280285.db2.gz PXNBWEXKXQUXIH-INIZCTEOSA-N 0 3 306.381 4.279 20 5 DIBDHN CCSc1ccc(CNCc2cccc([N+](=O)[O-])c2C)cc1 ZINC001474248489 1061814038 /nfs/dbraw/zinc/81/40/38/1061814038.db2.gz RWRNPPUTIHGUSM-UHFFFAOYSA-N 0 3 316.426 4.305 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCS[C@H]2CCCC[C@@H]21 ZINC001474343613 1061946282 /nfs/dbraw/zinc/94/62/82/1061946282.db2.gz SEKGWCBKKKPHMA-IRXDYDNUSA-N 0 3 320.458 4.072 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCS[C@@H]2CCCC[C@H]21 ZINC001474343612 1061947967 /nfs/dbraw/zinc/94/79/67/1061947967.db2.gz SEKGWCBKKKPHMA-IAGOWNOFSA-N 0 3 320.458 4.072 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCS[C@H]2CCCC[C@H]21 ZINC001474343614 1061948641 /nfs/dbraw/zinc/94/86/41/1061948641.db2.gz SEKGWCBKKKPHMA-SJORKVTESA-N 0 3 320.458 4.072 20 5 DIBDHN CC(C)(C)[C@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC001459494395 1062170497 /nfs/dbraw/zinc/17/04/97/1062170497.db2.gz VXWFJQTUJKYUIJ-AWEZNQCLSA-N 0 3 308.397 4.382 20 5 DIBDHN C[C@@H]1[C@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1F ZINC001459623597 1062258923 /nfs/dbraw/zinc/25/89/23/1062258923.db2.gz MEHJQNHWXLJYLV-CXAGYDPISA-N 0 3 314.360 4.112 20 5 DIBDHN O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3ccccc3F)C2)cc1 ZINC001460126773 1062649294 /nfs/dbraw/zinc/64/92/94/1062649294.db2.gz FPYVPXHXGDXEBJ-OAHLLOKOSA-N 0 3 314.360 4.114 20 5 DIBDHN Cc1ccccc1C1(NCc2cccc([N+](=O)[O-])c2C)CCC1 ZINC001460331037 1062787039 /nfs/dbraw/zinc/78/70/39/1062787039.db2.gz JLSHTUFXFRWFJG-UHFFFAOYSA-N 0 3 310.397 4.381 20 5 DIBDHN Cc1cc(CN[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1F ZINC001461254216 1063369596 /nfs/dbraw/zinc/36/95/96/1063369596.db2.gz HPWFSZZWAIXPGX-ZDUSSCGKSA-N 0 3 302.349 4.202 20 5 DIBDHN Cc1cc(C)nc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC001461362914 1063445361 /nfs/dbraw/zinc/44/53/61/1063445361.db2.gz YCTKOXZOBRQEEY-UHFFFAOYSA-N 0 3 323.352 4.479 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C[C@H](C)CCC[C@@H]1C ZINC001307478086 1065425986 /nfs/dbraw/zinc/42/59/86/1065425986.db2.gz ISEUSHLTDYFNAB-CABCVRRESA-N 0 3 320.433 4.393 20 5 DIBDHN CC[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H]1C ZINC001307703643 1065573506 /nfs/dbraw/zinc/57/35/06/1065573506.db2.gz WRKMWQOYPSDKNY-KGLIPLIRSA-N 0 3 306.406 4.002 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC(F)(C2CC2)CC1 ZINC001308129521 1065772260 /nfs/dbraw/zinc/77/22/60/1065772260.db2.gz CQPKAOMELMNDQM-CYBMUJFWSA-N 0 3 306.381 4.178 20 5 DIBDHN CCCCCC(C)(C)C[NH2+]Cc1cc(OC)c([O-])cc1[N+](=O)[O-] ZINC001308307798 1065902379 /nfs/dbraw/zinc/90/23/79/1065902379.db2.gz NJXXDUZLIRTALO-UHFFFAOYSA-N 0 3 324.421 4.005 20 5 DIBDHN CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1[O-] ZINC000903287293 1066103290 /nfs/dbraw/zinc/10/32/90/1066103290.db2.gz NBMASGUTBAWCOI-DYVFJYSZSA-N 0 3 314.385 4.411 20 5 DIBDHN CCN(Cc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000518474194 332061405 /nfs/dbraw/zinc/06/14/05/332061405.db2.gz XVESNGJAJAGQMU-CQSZACIVSA-N 0 3 314.385 4.187 20 5 DIBDHN CCN(Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000518474635 332061603 /nfs/dbraw/zinc/06/16/03/332061603.db2.gz PUMJHNUAWYRQIS-ZDUSSCGKSA-N 0 3 302.349 4.317 20 5 DIBDHN Cc1c(CN(Cc2cccc(F)c2)C(C)C)cccc1[N+](=O)[O-] ZINC000518600285 332091232 /nfs/dbraw/zinc/09/12/32/332091232.db2.gz QEVNVXINYJBHGU-UHFFFAOYSA-N 0 3 316.376 4.453 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCC[C@H]3F)s2)cc1 ZINC000559358043 332126386 /nfs/dbraw/zinc/12/63/86/332126386.db2.gz HDNZQWZUXYYJMC-CABCVRRESA-N 0 3 320.389 4.304 20 5 DIBDHN CS[C@@H](C)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180996942 332173012 /nfs/dbraw/zinc/17/30/12/332173012.db2.gz ISFRQTICVBYSRE-SUMWQHHRSA-N 0 3 316.426 4.025 20 5 DIBDHN C[C@@H](NCc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000170686246 332635488 /nfs/dbraw/zinc/63/54/88/332635488.db2.gz FNDWEAUBSLBEBL-LLVKDONJSA-N 0 3 324.302 4.464 20 5 DIBDHN Cc1c(CN[C@H](C)c2ccc3c(c2)CCC3)cccc1[N+](=O)[O-] ZINC000391101021 333420032 /nfs/dbraw/zinc/42/00/32/333420032.db2.gz PLTLPKKEQXAEKH-CQSZACIVSA-N 0 3 310.397 4.243 20 5 DIBDHN C[C@@H](N[C@H]1CCCc2sccc21)c1cccc([N+](=O)[O-])c1 ZINC000061328356 333427664 /nfs/dbraw/zinc/42/76/64/333427664.db2.gz CMSRWEXAIILQJN-ABAIWWIYSA-N 0 3 302.399 4.385 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)N[C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000571298279 333716082 /nfs/dbraw/zinc/71/60/82/333716082.db2.gz VAPGORDHVMTAEA-QWHCGFSZSA-N 0 3 316.323 4.149 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000438472391 334117366 /nfs/dbraw/zinc/11/73/66/334117366.db2.gz XSNVHMYHNPEOIT-VUDGCMKMSA-N 0 3 316.323 4.175 20 5 DIBDHN COCC[C@@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341572578 334453602 /nfs/dbraw/zinc/45/36/02/334453602.db2.gz JWHAQDWFMGGONR-RDTXWAMCSA-N 0 3 314.385 4.023 20 5 DIBDHN O=[N+]([O-])c1cccc([C@H](NC[C@@H]2CC23CC3)c2ccccc2)c1 ZINC000417330098 334709213 /nfs/dbraw/zinc/70/92/13/334709213.db2.gz AGENACRAQYGWAE-FUHWJXTLSA-N 0 3 308.381 4.074 20 5 DIBDHN COc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000537964071 335311908 /nfs/dbraw/zinc/31/19/08/335311908.db2.gz DWCHPKZSFNFGLU-CQSZACIVSA-N 0 3 314.385 4.071 20 5 DIBDHN CO[C@@]1(C)CCCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000332230264 336164231 /nfs/dbraw/zinc/16/42/31/336164231.db2.gz OEZXVPQSIMLJKY-SFHVURJKSA-N 0 3 320.433 4.109 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H]1CCCC(F)(F)C1)CCC2 ZINC000332252443 336164965 /nfs/dbraw/zinc/16/49/65/336164965.db2.gz YBMLBHQSWCQMOH-IUODEOHRSA-N 0 3 310.344 4.140 20 5 DIBDHN CC[C@@H](N[C@H](C)c1sc(C)nc1C)c1cccc([N+](=O)[O-])c1 ZINC000194384493 338516960 /nfs/dbraw/zinc/51/69/60/338516960.db2.gz HVMUQXJRQYNQLF-IAQYHMDHSA-N 0 3 319.430 4.470 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCCc1c(F)cccc1F ZINC000532473142 336249855 /nfs/dbraw/zinc/24/98/55/336249855.db2.gz TZTOZKARGAZDQT-GFCCVEGCSA-N 0 3 320.339 4.075 20 5 DIBDHN CC[C@H](NCC1(C(F)(F)F)CCC1)c1cccc([N+](=O)[O-])c1 ZINC000353953620 336450901 /nfs/dbraw/zinc/45/09/01/336450901.db2.gz GQZQLSSPHWSHBP-ZDUSSCGKSA-N 0 3 316.323 4.368 20 5 DIBDHN CC[C@H](N[C@H](c1cccnc1)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000358377622 336627277 /nfs/dbraw/zinc/62/72/77/336627277.db2.gz JJSLTBFJZYEHQT-ROUUACIJSA-N 0 3 311.385 4.182 20 5 DIBDHN CCO[C@@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000193522532 337038154 /nfs/dbraw/zinc/03/81/54/337038154.db2.gz PVBUIDRROOWTCK-KSSFIOAISA-N 0 3 314.385 4.023 20 5 DIBDHN CCO[C@H](CN[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000193522543 337038232 /nfs/dbraw/zinc/03/82/32/337038232.db2.gz PVBUIDRROOWTCK-KBXCAEBGSA-N 0 3 314.385 4.023 20 5 DIBDHN Cc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1F ZINC000119404708 337858230 /nfs/dbraw/zinc/85/82/30/337858230.db2.gz MFIOCWYDUSEPPA-CYBMUJFWSA-N 0 3 302.349 4.202 20 5 DIBDHN CC(C)(NCCCc1ccsc1)c1ccccc1[N+](=O)[O-] ZINC000429246835 338074657 /nfs/dbraw/zinc/07/46/57/338074657.db2.gz HUJJODNHYMJFEM-UHFFFAOYSA-N 0 3 304.415 4.114 20 5 DIBDHN CSC[C@@H]1CCCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000430200287 338101226 /nfs/dbraw/zinc/10/12/26/338101226.db2.gz UGCCMBJFTYATOY-SCZPIIQISA-N 0 3 320.458 4.073 20 5 DIBDHN CN(CCSCc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000433021391 338176698 /nfs/dbraw/zinc/17/66/98/338176698.db2.gz GGGPODFHXNUEGG-UHFFFAOYSA-N 0 3 322.455 4.022 20 5 DIBDHN C[C@H](N[C@H]1C[C@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000435674124 338244827 /nfs/dbraw/zinc/24/48/27/338244827.db2.gz PSZFHJXMRIMZIJ-QEJZJMRPSA-N 0 3 314.360 4.331 20 5 DIBDHN C[C@@H](N[C@H]1C[C@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000435674123 338244829 /nfs/dbraw/zinc/24/48/29/338244829.db2.gz PSZFHJXMRIMZIJ-BPLDGKMQSA-N 0 3 314.360 4.331 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000435729415 338246547 /nfs/dbraw/zinc/24/65/47/338246547.db2.gz CUMRKFFRKQRZFX-KOMQPUFPSA-N 0 3 316.788 4.284 20 5 DIBDHN Cc1c(CN[C@@H](c2ccc(F)cc2)C2CC2)cccc1[N+](=O)[O-] ZINC000155030973 338253393 /nfs/dbraw/zinc/25/33/93/338253393.db2.gz GSTNZGIDEBOCDH-GOSISDBHSA-N 0 3 314.360 4.283 20 5 DIBDHN CC(C)[C@H](CC(F)(F)F)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000437113341 338301627 /nfs/dbraw/zinc/30/16/27/338301627.db2.gz WRGKMDXPGFNTFQ-MFKMUULPSA-N 0 3 304.312 4.222 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H](c1cccnc1)C1CC1)CCC2 ZINC000447587073 338559776 /nfs/dbraw/zinc/55/97/76/338559776.db2.gz OJACXLWKPWIDQY-OALUTQOASA-N 0 3 323.396 4.108 20 5 DIBDHN Cc1ccc(CN[C@@H]2CCCc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000449348874 338616003 /nfs/dbraw/zinc/61/60/03/338616003.db2.gz HOIHOWGTDDIIFG-QGZVFWFLSA-N 0 3 314.360 4.210 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCCc2c(F)cccc21 ZINC000449351429 338616479 /nfs/dbraw/zinc/61/64/79/338616479.db2.gz PHPZUXSKFCGKLX-GOSISDBHSA-N 0 3 314.360 4.210 20 5 DIBDHN O=[N+]([O-])c1cc(CNC2CC3(CCC3)C2)cc(C(F)(F)F)c1 ZINC000459513996 339033457 /nfs/dbraw/zinc/03/34/57/339033457.db2.gz LETAFMAKANZTRX-UHFFFAOYSA-N 0 3 314.307 4.036 20 5 DIBDHN O=[N+]([O-])c1cccc([C@@H](NCCCCF)c2ccccc2)c1 ZINC000462806189 339090359 /nfs/dbraw/zinc/09/03/59/339090359.db2.gz GCWHFEYMKMUBGD-KRWDZBQOSA-N 0 3 302.349 4.024 20 5 DIBDHN CC(C)c1ccc(CN[C@H](C)CC(F)(F)F)cc1[N+](=O)[O-] ZINC000463710960 339124312 /nfs/dbraw/zinc/12/43/12/339124312.db2.gz PFZNMUGSVDVNOS-SNVBAGLBSA-N 0 3 304.312 4.149 20 5 DIBDHN COc1cc(CN2CCCC23CCCCC3)c([N+](=O)[O-])cc1F ZINC000464680847 339148663 /nfs/dbraw/zinc/14/86/63/339148663.db2.gz NSNZKAYDBWHRGW-UHFFFAOYSA-N 0 3 322.380 4.041 20 5 DIBDHN CSc1ccc([C@H](C)NCc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000466413806 339203357 /nfs/dbraw/zinc/20/33/57/339203357.db2.gz DOXXJVOAHYVQBD-ZDUSSCGKSA-N 0 3 316.426 4.476 20 5 DIBDHN CSc1ccc([C@@H](C)NCc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000466418959 339203655 /nfs/dbraw/zinc/20/36/55/339203655.db2.gz DOXXJVOAHYVQBD-CYBMUJFWSA-N 0 3 316.426 4.476 20 5 DIBDHN C[C@H](NC[C@@H]1CCC2(CCCCC2)O1)c1ccccc1[N+](=O)[O-] ZINC000467189506 339227584 /nfs/dbraw/zinc/22/75/84/339227584.db2.gz DXQSCENFCKTLGW-GJZGRUSLSA-N 0 3 318.417 4.127 20 5 DIBDHN C[C@H](NCCc1ccccc1[N+](=O)[O-])c1csc(Cl)c1 ZINC000467974268 339250336 /nfs/dbraw/zinc/25/03/36/339250336.db2.gz STTZJTORUYXPFY-JTQLQIEISA-N 0 3 310.806 4.203 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CNCc1sccc1C ZINC000468644215 339267896 /nfs/dbraw/zinc/26/78/96/339267896.db2.gz YWCAMGCHRRNZGM-WQLSENKSSA-N 0 3 302.399 4.158 20 5 DIBDHN CCS[C@@H]1CCCC[C@@H]1N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000469794233 339300533 /nfs/dbraw/zinc/30/05/33/339300533.db2.gz OHTVLQQDILGETK-IVMMDQJWSA-N 0 3 308.447 4.310 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN(C)[C@H](C)c1ccco1 ZINC000470170000 339312520 /nfs/dbraw/zinc/31/25/20/339312520.db2.gz NEDRBTVCFFBPKG-JWAFFJSPSA-N 0 3 300.358 4.284 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN(C)[C@@H](C)c1ccco1 ZINC000470170003 339312541 /nfs/dbraw/zinc/31/25/41/339312541.db2.gz NEDRBTVCFFBPKG-ZVHGMHCTSA-N 0 3 300.358 4.284 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H]1c1ccccc1 ZINC000470172982 339312728 /nfs/dbraw/zinc/31/27/28/339312728.db2.gz GKTJZNGCBASIOQ-QZEGLACASA-N 0 3 308.381 4.445 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN[C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000475328480 339446684 /nfs/dbraw/zinc/44/66/84/339446684.db2.gz BUODRHRIDSJGRI-YOEHRIQHSA-N 0 3 314.360 4.160 20 5 DIBDHN O=[N+]([O-])c1cc(CN[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)cs1 ZINC000475335411 339447306 /nfs/dbraw/zinc/44/73/06/339447306.db2.gz HEHBYMLRVPVHDD-UKRRQHHQSA-N 0 3 320.389 4.221 20 5 DIBDHN COCCC1(CN[C@H](C)c2ccccc2[N+](=O)[O-])CCCCC1 ZINC000478920806 339524739 /nfs/dbraw/zinc/52/47/39/339524739.db2.gz HOBKAVBGILGFSA-OAHLLOKOSA-N 0 3 320.433 4.232 20 5 DIBDHN Cc1cc(CNCc2cccc([N+](=O)[O-])c2C)ccc1Cl ZINC000480489746 339574739 /nfs/dbraw/zinc/57/47/39/339574739.db2.gz XCKYELNEUSPARD-UHFFFAOYSA-N 0 3 304.777 4.155 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CCCO[C@@H]2CC(C)C)cc1[N+](=O)[O-] ZINC000480724531 339584741 /nfs/dbraw/zinc/58/47/41/339584741.db2.gz VSXSDDQQIDONKP-YXJHDRRASA-N 0 3 320.433 4.148 20 5 DIBDHN C[C@H](NCC(C)(C)Oc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000483130132 339653117 /nfs/dbraw/zinc/65/31/17/339653117.db2.gz NEQGLLCFKYGVDK-AWEZNQCLSA-N 0 3 314.385 4.103 20 5 DIBDHN Cc1ccc(O[C@H](C)CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000483631055 339670020 /nfs/dbraw/zinc/67/00/20/339670020.db2.gz CJLKDHNXRTUIQP-HUUCEWRRSA-N 0 3 314.385 4.021 20 5 DIBDHN CCOc1cc(CNC(C)(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000492769185 339908407 /nfs/dbraw/zinc/90/84/07/339908407.db2.gz KHRDPBPPSSQDPX-UHFFFAOYSA-N 0 3 314.385 4.018 20 5 DIBDHN Cc1cscc1CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000494464843 339950147 /nfs/dbraw/zinc/95/01/47/339950147.db2.gz LXAXTSKCNSVTDG-MRXNPFEDSA-N 0 3 302.399 4.132 20 5 DIBDHN CCSCCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000500376933 340056013 /nfs/dbraw/zinc/05/60/13/340056013.db2.gz MWHSDWVOCRZRSX-UHFFFAOYSA-N 0 3 320.414 4.088 20 5 DIBDHN CC[C@H]1C[C@]1(NCc1cccc([N+](=O)[O-])c1)c1cccc(C)c1 ZINC000500537668 340061833 /nfs/dbraw/zinc/06/18/33/340061833.db2.gz UKRVGPXTBLZSSK-QFBILLFUSA-N 0 3 310.397 4.318 20 5 DIBDHN O=[N+]([O-])c1cc(CNC2CCC2)ccc1Oc1ccc(F)cc1 ZINC000501345642 340078776 /nfs/dbraw/zinc/07/87/76/340078776.db2.gz AEBKMRTWCKXVSQ-UHFFFAOYSA-N 0 3 316.332 4.168 20 5 DIBDHN O=[N+]([O-])c1cccc(CN(Cc2ccc(F)cc2)CC2CC2)c1 ZINC000503674329 340133394 /nfs/dbraw/zinc/13/33/94/340133394.db2.gz RJMDWPNXZDGTSZ-UHFFFAOYSA-N 0 3 314.360 4.146 20 5 DIBDHN CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC1 ZINC000507131543 340208618 /nfs/dbraw/zinc/20/86/18/340208618.db2.gz JPTIPCOVZGDFBW-UHFFFAOYSA-N 0 3 306.749 4.102 20 5 DIBDHN C[C@H](c1cccs1)N(C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000507442258 340219769 /nfs/dbraw/zinc/21/97/69/340219769.db2.gz OBPSXGPPHFHHEV-DMTLFAOVSA-N 0 3 302.399 4.363 20 5 DIBDHN CCN(CCc1cccs1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000508731762 340251943 /nfs/dbraw/zinc/25/19/43/340251943.db2.gz CYSGWLXHZRFWHA-UHFFFAOYSA-N 0 3 304.415 4.029 20 5 DIBDHN C[C@@]1(c2ccccc2)CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000303528721 340330546 /nfs/dbraw/zinc/33/05/46/340330546.db2.gz DOWFHSGEHJCELE-LJQANCHMSA-N 0 3 310.397 4.149 20 5 DIBDHN CC(C)(NCc1ccc2occc2c1)c1ccc([N+](=O)[O-])cc1 ZINC000511988195 340344652 /nfs/dbraw/zinc/34/46/52/340344652.db2.gz GSUROJKXPPWANW-UHFFFAOYSA-N 0 3 310.353 4.366 20 5 DIBDHN CC[C@@H](N[C@@H]1CCc2c1cccc2F)c1cccc([N+](=O)[O-])c1 ZINC000513858276 340428870 /nfs/dbraw/zinc/42/88/70/340428870.db2.gz XBUSEECRZANIJV-QZTJIDSGSA-N 0 3 314.360 4.462 20 5 DIBDHN CS[C@@H]1CCC[C@H](NCc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000230143287 340619144 /nfs/dbraw/zinc/61/91/44/340619144.db2.gz RXUARDRUKXHIDD-WCQYABFASA-N 0 3 314.838 4.012 20 5 DIBDHN C[C@@H](N[C@H]1CCc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1 ZINC000540167742 340919928 /nfs/dbraw/zinc/91/99/28/340919928.db2.gz SENDKZZSYFVSPE-DIFFPNOSSA-N 0 3 300.333 4.072 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@@H]2CCCc3c(Cl)cccc32)cc1 ZINC000543598948 341050470 /nfs/dbraw/zinc/05/04/70/341050470.db2.gz JLJCUFKKMWIJQZ-QGZVFWFLSA-N 0 3 316.788 4.415 20 5 DIBDHN Cc1ccc(CN[C@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000543748299 341056555 /nfs/dbraw/zinc/05/65/55/341056555.db2.gz RJOVHMOULHZQOU-LJQANCHMSA-N 0 3 310.397 4.245 20 5 DIBDHN Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H]1c1cccs1 ZINC000544613646 341089195 /nfs/dbraw/zinc/08/91/95/341089195.db2.gz KAPYUUJUCCCFID-HNNXBMFYSA-N 0 3 302.399 4.302 20 5 DIBDHN Cc1c([C@H](C)NCCCNc2ccccc2)cccc1[N+](=O)[O-] ZINC000132065460 341115748 /nfs/dbraw/zinc/11/57/48/341115748.db2.gz GRKMNNUOFDUYOD-HNNXBMFYSA-N 0 3 313.401 4.056 20 5 DIBDHN CC(C)(CCc1ccccc1)NCc1csc([N+](=O)[O-])c1 ZINC000134521191 341217006 /nfs/dbraw/zinc/21/70/06/341217006.db2.gz VXKARNZYTLOBDL-UHFFFAOYSA-N 0 3 304.415 4.157 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H](C)c2ccc3n[nH]cc3c2)cc1[N+](=O)[O-] ZINC000552339812 341387762 /nfs/dbraw/zinc/38/77/62/341387762.db2.gz DPHHQRRFGHZBRN-STQMWFEESA-N 0 3 324.384 4.191 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000552515103 341397109 /nfs/dbraw/zinc/39/71/09/341397109.db2.gz YJKCHBZUIOBMEX-CZUORRHYSA-N 0 3 314.360 4.284 20 5 DIBDHN C[C@@H](NC[C@@H](C)c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000552557515 341398610 /nfs/dbraw/zinc/39/86/10/341398610.db2.gz VBYOABMKWAYFQN-CHWSQXEVSA-N 0 3 302.349 4.188 20 5 DIBDHN CC(C)SCCNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000568318911 341665097 /nfs/dbraw/zinc/66/50/97/341665097.db2.gz IKACISJMIMTBDN-UHFFFAOYSA-N 0 3 320.414 4.086 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H]1CCCc2sccc21 ZINC000574414475 341757982 /nfs/dbraw/zinc/75/79/82/341757982.db2.gz NHGUQBWDKYXEIR-HUUCEWRRSA-N 0 3 314.410 4.311 20 5 DIBDHN Cc1cccc2c1CC[C@@H]2N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574583954 341763057 /nfs/dbraw/zinc/76/30/57/341763057.db2.gz RTHQUQPEAJGYLN-ZWKOTPCHSA-N 0 3 308.381 4.168 20 5 DIBDHN CC(C)SCCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000577095238 341885459 /nfs/dbraw/zinc/88/54/59/341885459.db2.gz DWJNEBUAXLJENI-UHFFFAOYSA-N 0 3 320.414 4.086 20 5 DIBDHN CC[C@H](NC[C@H](C)c1c(C)noc1C)c1cccc([N+](=O)[O-])c1 ZINC000181630816 522627998 /nfs/dbraw/zinc/62/79/98/522627998.db2.gz MMOCDMLPHLGBGN-ZBEGNZNMSA-N 0 3 317.389 4.044 20 5 DIBDHN CSC[C@H]1CCCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000430193414 1035667643 /nfs/dbraw/zinc/66/76/43/1035667643.db2.gz GCGPRNUTZJVINX-HNNXBMFYSA-N 0 3 322.474 4.293 20 5 DIBDHN Cc1ccc([C@@H]2CCCN2Cc2ccccc2[N+](=O)[O-])s1 ZINC000261448007 1036205340 /nfs/dbraw/zinc/20/53/40/1036205340.db2.gz DCGVKOLEZLJMRQ-HNNXBMFYSA-N 0 3 302.399 4.302 20 5 DIBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCC(C)(C)O1 ZINC001167188239 1036255647 /nfs/dbraw/zinc/25/56/47/1036255647.db2.gz YPQUYVHYBUBSCB-QGZVFWFLSA-N 0 3 320.433 4.153 20 5 DIBDHN CC(C)[C@H](C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610089330 1036930603 /nfs/dbraw/zinc/93/06/03/1036930603.db2.gz NJKDIQQYCQEEET-GFCCVEGCSA-N 0 3 319.430 4.100 20 5 DIBDHN COCC[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341572576 1038141714 /nfs/dbraw/zinc/14/17/14/1038141714.db2.gz JWHAQDWFMGGONR-KDOFPFPSSA-N 0 3 314.385 4.023 20 5 DIBDHN CCCc1ccc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000598640867 1038144503 /nfs/dbraw/zinc/14/45/03/1038144503.db2.gz OTSSISUNUXKXKB-GFCCVEGCSA-N 0 3 304.415 4.460 20 5 DIBDHN CN(Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCC(C)(C)CC1 ZINC000610676597 1038250715 /nfs/dbraw/zinc/25/07/15/1038250715.db2.gz AQBZVFLWZFYSPU-UHFFFAOYSA-N 0 3 317.389 4.137 20 5 DIBDHN CC(C)CC[C@@H]1CCCN1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610859390 1038381419 /nfs/dbraw/zinc/38/14/19/1038381419.db2.gz OLFSAFLDXPSKOI-ZDUSSCGKSA-N 0 3 317.389 4.137 20 5 DIBDHN O=[N+]([O-])c1ccc(CN[C@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000539094448 1038523685 /nfs/dbraw/zinc/52/36/85/1038523685.db2.gz WIKNRZBHEAQQAQ-KRWDZBQOSA-N 0 3 316.788 4.415 20 5 DIBDHN CCCOc1ccc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178646385 1038835036 /nfs/dbraw/zinc/83/50/36/1038835036.db2.gz AQIFCQDSBKXVTM-AWEZNQCLSA-N 0 3 314.385 4.234 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@@H]2CCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000178687505 1038979746 /nfs/dbraw/zinc/97/97/46/1038979746.db2.gz AWGIHTDNNBZXFK-SJKOYZFVSA-N 0 3 314.360 4.380 20 5 DIBDHN CCN(Cc1c[nH]c2ccccc12)Cc1ccc([N+](=O)[O-])cc1 ZINC000442882800 1039241309 /nfs/dbraw/zinc/24/13/09/1039241309.db2.gz SOZKPBBKOYIWTH-UHFFFAOYSA-N 0 3 309.369 4.098 20 5 DIBDHN CN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCCC1 ZINC000089883445 1039281466 /nfs/dbraw/zinc/28/14/66/1039281466.db2.gz ASEBTYTZJXYVCW-UHFFFAOYSA-N 0 3 315.373 4.014 20 5 DIBDHN C[C@@H]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000609147438 1039817092 /nfs/dbraw/zinc/81/70/92/1039817092.db2.gz UPUZOLAPJNSTLH-DVOMOZLQSA-N 0 3 306.381 4.135 20 5 DIBDHN CC(C)(NC/C=C/c1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000492442698 1039963372 /nfs/dbraw/zinc/96/33/72/1039963372.db2.gz PTDJCFSZEPSBIE-AATRIKPKSA-N 0 3 314.360 4.272 20 5 DIBDHN COc1cc(CN[C@@H](C)c2cccc(C)c2C)ccc1[N+](=O)[O-] ZINC000492935768 1040042696 /nfs/dbraw/zinc/04/26/96/1040042696.db2.gz HOJZCNSUKCKMKO-AWEZNQCLSA-N 0 3 314.385 4.071 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000414062313 1040804354 /nfs/dbraw/zinc/80/43/54/1040804354.db2.gz CMSPEZUZIGWWQJ-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN COc1ccc([C@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000414062306 1040804476 /nfs/dbraw/zinc/80/44/76/1040804476.db2.gz CMSPEZUZIGWWQJ-KBPBESRZSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@H](N[C@H]1CCc2cc(F)ccc21)c1cccc([N+](=O)[O-])c1 ZINC000173361548 1040885962 /nfs/dbraw/zinc/88/59/62/1040885962.db2.gz NOPFVJMWJMOQSM-GTNSWQLSSA-N 0 3 300.333 4.072 20 5 DIBDHN CCSCCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811500442 1041525942 /nfs/dbraw/zinc/52/59/42/1041525942.db2.gz CLPDEMYWVARTHT-UHFFFAOYSA-N 0 3 323.245 4.134 20 5 DIBDHN CC1(C)C[C@H](NCc2cccs2)c2cc([N+](=O)[O-])ccc21 ZINC000433180562 1042459111 /nfs/dbraw/zinc/45/91/11/1042459111.db2.gz WBDWHICPKHHWEY-HNNXBMFYSA-N 0 3 302.399 4.169 20 5 DIBDHN Cc1ccccc1C[C@H]1CCCN1Cc1csc([N+](=O)[O-])c1 ZINC000514179452 1042773286 /nfs/dbraw/zinc/77/32/86/1042773286.db2.gz RINLENKFTVJMBV-MRXNPFEDSA-N 0 3 316.426 4.172 20 5 DIBDHN Cc1oc2ccccc2c1CN[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000518215189 1042911453 /nfs/dbraw/zinc/91/14/53/1042911453.db2.gz OPLUKLKCBZKGDA-QGZVFWFLSA-N 0 3 322.364 4.427 20 5 DIBDHN CC(C)Oc1ccc([N+](=O)[O-])cc1CN([C@H](C)C1CC1)C1CC1 ZINC000519160609 1042936024 /nfs/dbraw/zinc/93/60/24/1042936024.db2.gz QWJSADWUIBSUQS-CYBMUJFWSA-N 0 3 318.417 4.145 20 5 DIBDHN Cc1ccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000120786043 1042951872 /nfs/dbraw/zinc/95/18/72/1042951872.db2.gz LXCFBXAYNHMTKL-CHWSQXEVSA-N 0 3 302.349 4.454 20 5 DIBDHN CCOc1cccc([C@@H](C)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178651282 1043134993 /nfs/dbraw/zinc/13/49/93/1043134993.db2.gz PLAQSKLGORRNNW-UONOGXRCSA-N 0 3 314.385 4.405 20 5 DIBDHN C[C@H](N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000866606835 1043233327 /nfs/dbraw/zinc/23/33/27/1043233327.db2.gz IRPYZOJRUJRSQL-ZLKJLUDKSA-N 0 3 314.307 4.143 20 5 DIBDHN C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)COC2 ZINC000268811584 1043333670 /nfs/dbraw/zinc/33/36/70/1043333670.db2.gz OCQZHPBTRHTCLK-QWHCGFSZSA-N 0 3 312.369 4.037 20 5 DIBDHN COc1cccc([C@H](C)N[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000268803131 1043333749 /nfs/dbraw/zinc/33/37/49/1043333749.db2.gz QUNVVCBXZKHHLH-UONOGXRCSA-N 0 3 314.385 4.324 20 5 DIBDHN COc1ccc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000269024779 1043353180 /nfs/dbraw/zinc/35/31/80/1043353180.db2.gz QHALGRYLHUEWTN-ZIAGYGMSSA-N 0 3 314.385 4.324 20 5 DIBDHN C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](OC2CCC2)CC1 ZINC000872276851 1043487551 /nfs/dbraw/zinc/48/75/51/1043487551.db2.gz MYVQFQVLEYIMSS-RDTXWAMCSA-N 0 3 318.417 4.079 20 5 DIBDHN CC[C@H](c1cccc(OC)c1)N(C)Cc1cccc([N+](=O)[O-])c1 ZINC000521938738 1043510685 /nfs/dbraw/zinc/51/06/85/1043510685.db2.gz OJIJLTYPUOANIX-GOSISDBHSA-N 0 3 314.385 4.187 20 5 DIBDHN C[C@H](NCc1ccc(C(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000184927828 1043560659 /nfs/dbraw/zinc/56/06/59/1043560659.db2.gz OVXAJYCANSUTQV-NSHDSACASA-N 0 3 306.312 4.383 20 5 DIBDHN COc1cccc([C@@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000267470468 1043578614 /nfs/dbraw/zinc/57/86/14/1043578614.db2.gz XQDJCTVAWKVYED-CHWSQXEVSA-N 0 3 300.358 4.015 20 5 DIBDHN CC[C@@H](NCc1ccc(OC)c([N+](=O)[O-])c1)c1cccc(C)c1 ZINC000353385973 1043603949 /nfs/dbraw/zinc/60/39/49/1043603949.db2.gz LCVXDYBXJQRXSR-MRXNPFEDSA-N 0 3 314.385 4.153 20 5 DIBDHN Cc1c(CN[C@@H]2CCCc3cc(F)ccc32)cccc1[N+](=O)[O-] ZINC000357706075 1043978975 /nfs/dbraw/zinc/97/89/75/1043978975.db2.gz JSUINDCFWQAWEJ-QGZVFWFLSA-N 0 3 314.360 4.210 20 5 DIBDHN C[C@@H](NCc1cccc(C(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000932177786 1044106886 /nfs/dbraw/zinc/10/68/86/1044106886.db2.gz RVFPPVVOVDPQEL-LLVKDONJSA-N 0 3 306.312 4.383 20 5 DIBDHN CSc1cccc(CN[C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000932177510 1044107193 /nfs/dbraw/zinc/10/71/93/1044107193.db2.gz AKPFYPUOYFQLHT-GFCCVEGCSA-N 0 3 302.399 4.168 20 5 DIBDHN O=[N+]([O-])c1cccc(CNC[C@H](c2ccccc2)C(F)(F)F)c1 ZINC000186438862 1044423207 /nfs/dbraw/zinc/42/32/07/1044423207.db2.gz LKGIUDHPRYKCJY-OAHLLOKOSA-N 0 3 324.302 4.031 20 5 DIBDHN C[C@H](c1ccccc1[N+](=O)[O-])N(C)CC1(c2ccccc2)CC1 ZINC000444669357 1044597476 /nfs/dbraw/zinc/59/74/76/1044597476.db2.gz FEKCCUMCSQINAF-OAHLLOKOSA-N 0 3 310.397 4.319 20 5 DIBDHN CCc1ccc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000156289050 1044788290 /nfs/dbraw/zinc/78/82/90/1044788290.db2.gz BWOOOBIQCBKRHX-GFCCVEGCSA-N 0 3 304.415 4.378 20 5 DIBDHN CCOc1cc(CN[C@@H](CC)c2ccccc2)ccc1[N+](=O)[O-] ZINC000411888951 1045036275 /nfs/dbraw/zinc/03/62/75/1045036275.db2.gz SQGGJSFKRIXDGY-INIZCTEOSA-N 0 3 314.385 4.234 20 5 DIBDHN O=[N+]([O-])c1ccc2c(c1)[C@H](NCc1cccc(Cl)c1)CCC2 ZINC000447511394 1045137532 /nfs/dbraw/zinc/13/75/32/1045137532.db2.gz TYQMEVYHPRZFCS-QGZVFWFLSA-N 0 3 316.788 4.415 20 5 DIBDHN Cc1cc(Cl)cc(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000449348342 1045379255 /nfs/dbraw/zinc/37/92/55/1045379255.db2.gz MDQKVLWEOLWYFL-LBPRGKRZSA-N 0 3 304.777 4.407 20 5 DIBDHN C[C@@H]1[C@H](c2ccccc2)CCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000751500022 1045607769 /nfs/dbraw/zinc/60/77/69/1045607769.db2.gz NGZZCUHUSWXKAX-CXAGYDPISA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@@H]1[C@@H](c2ccccc2)CCN1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000751500023 1045607972 /nfs/dbraw/zinc/60/79/72/1045607972.db2.gz NGZZCUHUSWXKAX-DYVFJYSZSA-N 0 3 314.360 4.112 20 5 DIBDHN O=[N+]([O-])c1ccccc1CN1CCC(c2cccc(F)c2)CC1 ZINC000752092427 1045657882 /nfs/dbraw/zinc/65/78/82/1045657882.db2.gz KKDBADMHTKCPBC-UHFFFAOYSA-N 0 3 314.360 4.114 20 5 DIBDHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801517293 1045728033 /nfs/dbraw/zinc/72/80/33/1045728033.db2.gz LZBNLSIIUCXQDH-XJKSGUPXSA-N 0 3 314.360 4.112 20 5 DIBDHN C[C@@H]1C[C@@H](c2ccccc2)CN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801517292 1045729207 /nfs/dbraw/zinc/72/92/07/1045729207.db2.gz LZBNLSIIUCXQDH-CZUORRHYSA-N 0 3 314.360 4.112 20 5 DIBDHN CCC[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000801528996 1045730154 /nfs/dbraw/zinc/73/01/54/1045730154.db2.gz YDEKUCIUNQAANW-INIZCTEOSA-N 0 3 302.349 4.365 20 5 DIBDHN C[C@@H]1[C@H](c2ccccc2)CCN1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000801522050 1045730608 /nfs/dbraw/zinc/73/06/08/1045730608.db2.gz XZRDHSVIBFGBQR-CZUORRHYSA-N 0 3 314.360 4.112 20 5 DIBDHN Cc1ccc([C@H]2CCN(Cc3ccc([N+](=O)[O-])c(F)c3)C2)cc1 ZINC000801539925 1045734165 /nfs/dbraw/zinc/73/41/65/1045734165.db2.gz QZJPWDJWKOKGIY-INIZCTEOSA-N 0 3 314.360 4.032 20 5 DIBDHN CC[C@@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000453228748 1045994836 /nfs/dbraw/zinc/99/48/36/1045994836.db2.gz BZSQMFVLYHKDIM-SCLBCKFNSA-N 0 3 314.385 4.405 20 5 DIBDHN COc1cc([C@@H](C)N[C@H](C)c2ccc(C)s2)cc([N+](=O)[O-])c1 ZINC000903076541 1046157624 /nfs/dbraw/zinc/15/76/24/1046157624.db2.gz RRSJKRNAMFXWKP-VXGBXAGGSA-N 0 3 320.414 4.385 20 5 DIBDHN C[C@@H](NC[C@@H](C)c1ccccc1[N+](=O)[O-])c1cccnc1Cl ZINC000903244847 1046207312 /nfs/dbraw/zinc/20/73/12/1046207312.db2.gz FJLTWJUVOTYQHZ-VXGBXAGGSA-N 0 3 319.792 4.098 20 5 DIBDHN COc1ccc([C@H](C)N[C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000903286623 1046223766 /nfs/dbraw/zinc/22/37/66/1046223766.db2.gz DDYIXTLUVNSQPO-KGLIPLIRSA-N 0 3 314.385 4.324 20 5 DIBDHN CC(C)c1cnc(CNC[C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000897465796 1046439957 /nfs/dbraw/zinc/43/99/57/1046439957.db2.gz IKILGTNPQUMQAV-GFCCVEGCSA-N 0 3 319.430 4.068 20 5 DIBDHN Cc1c(CNCc2cccc3ccccc32)cccc1[N+](=O)[O-] ZINC000237810548 1046520096 /nfs/dbraw/zinc/52/00/96/1046520096.db2.gz RFKBVUFNWGMMLD-UHFFFAOYSA-N 0 3 306.365 4.346 20 5 DIBDHN CC(C)[C@@H](CC(F)(F)F)NCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000782656084 1046539851 /nfs/dbraw/zinc/53/98/51/1046539851.db2.gz PGEZYOYVVPIYOE-LLVKDONJSA-N 0 3 324.730 4.315 20 5 DIBDHN CN(Cc1ccncn1)Cc1c2ccccc2cc2ccccc21 ZINC001140348375 1046669805 /nfs/dbraw/zinc/66/98/05/1046669805.db2.gz TYHCWEYUEQCFOD-UHFFFAOYSA-N 0 3 313.404 4.415 20 5 DIBDHN O=[N+]([O-])c1ccc(Cl)cc1CNC1CC(c2ccccc2)C1 ZINC000798503305 1046959268 /nfs/dbraw/zinc/95/92/68/1046959268.db2.gz HROPYCFRUXHQML-UHFFFAOYSA-N 0 3 316.788 4.284 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CCc2cc(F)ccc21 ZINC000163503805 1047234626 /nfs/dbraw/zinc/23/46/26/1047234626.db2.gz RTOVSCPIHMZEHH-KPZWWZAWSA-N 0 3 314.360 4.380 20 5 DIBDHN Cc1ccccc1[C@H]1CCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000725804133 1047316263 /nfs/dbraw/zinc/31/62/63/1047316263.db2.gz IXEGMGZYTSAKRD-AWEZNQCLSA-N 0 3 314.360 4.032 20 5 DIBDHN CC[C@H](N[C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000192785903 1047628049 /nfs/dbraw/zinc/62/80/49/1047628049.db2.gz VMFDXCAFCVHBJH-UGSOOPFHSA-N 0 3 314.385 4.405 20 5 DIBDHN CC[C@H](N[C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 ZINC000192785926 1047628437 /nfs/dbraw/zinc/62/84/37/1047628437.db2.gz VMFDXCAFCVHBJH-ACJLOTCBSA-N 0 3 314.385 4.405 20 5 DIBDHN CN(Cc1cncn1C)Cc1c2ccccc2cc2ccccc21 ZINC001204387221 1047802366 /nfs/dbraw/zinc/80/23/66/1047802366.db2.gz JKIZMAUHEUHIBU-UHFFFAOYSA-N 0 3 315.420 4.359 20 5 DIBDHN Cc1n[nH]cc1Nc1cc2nc3cc(N)c(C)cc3cc2cc1C ZINC001174475499 1047849573 /nfs/dbraw/zinc/84/95/73/1047849573.db2.gz GCUMMTLALPPYAP-UHFFFAOYSA-N 0 3 317.396 4.362 20 5 DIBDHN CC(C)[C@@H](Cc1ccccc1)NCc1c(F)cccc1[N+](=O)[O-] ZINC001197759242 1047872924 /nfs/dbraw/zinc/87/29/24/1047872924.db2.gz PHRMFRQBEFQSCP-QGZVFWFLSA-N 0 3 316.376 4.091 20 5 DIBDHN O=[N+]([O-])c1ccc(CNCc2ccc(F)c3ccccc23)cc1 ZINC001199582149 1048077252 /nfs/dbraw/zinc/07/72/52/1048077252.db2.gz KVYCEHIGSPMDPD-UHFFFAOYSA-N 0 3 310.328 4.177 20 5 DIBDHN C/C=C\C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(OCC)c2)C1 ZINC001175052527 1048112530 /nfs/dbraw/zinc/11/25/30/1048112530.db2.gz GXNFIRMPJFWMIV-QTLSWZBMSA-N 0 3 318.417 4.172 20 5 DIBDHN CC[C@@](C)(NCc1ccc(C)c([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001175240381 1048212834 /nfs/dbraw/zinc/21/28/34/1048212834.db2.gz YZOWOOHPQFNVNZ-GOSISDBHSA-N 0 3 316.376 4.457 20 5 DIBDHN C[C@@H](NCc1ccc2scnc2c1)c1cccc([N+](=O)[O-])c1 ZINC001177328110 1048868969 /nfs/dbraw/zinc/86/89/69/1048868969.db2.gz HUCKTXCOZMRRFC-LLVKDONJSA-N 0 3 313.382 4.055 20 5 DIBDHN CC(C)[C@H]1c2ccccc2CCN1Cc1ccccc1[N+](=O)[O-] ZINC001191541978 1048960136 /nfs/dbraw/zinc/96/01/36/1048960136.db2.gz WMZGMRQPHRCULC-IBGZPJMESA-N 0 3 310.397 4.350 20 5 DIBDHN C[C@H](NCc1ccc2scnc2c1)c1ccc([N+](=O)[O-])cc1 ZINC001179579147 1049181134 /nfs/dbraw/zinc/18/11/34/1049181134.db2.gz KVAQLCODDGKHAI-NSHDSACASA-N 0 3 313.382 4.055 20 5 DIBDHN C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCS[C@@H](C(C)C)C1 ZINC001204681212 1049221352 /nfs/dbraw/zinc/22/13/52/1049221352.db2.gz ITYWLQUBJOKAGV-CRPZLVSXSA-N 0 3 320.458 4.072 20 5 DIBDHN C[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000485696554 1049320307 /nfs/dbraw/zinc/32/03/07/1049320307.db2.gz AAGVBXXVWQICFR-NSHDSACASA-N 0 3 313.382 4.055 20 5 DIBDHN Cc1ccsc1CN(C)[C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000485738917 1049330986 /nfs/dbraw/zinc/33/09/86/1049330986.db2.gz PSPBKJZJQRIMRZ-CYBMUJFWSA-N 0 3 304.415 4.466 20 5 DIBDHN C[C@H](NCc1cc2ccc(F)cc2[nH]1)c1cccc([N+](=O)[O-])c1 ZINC000486717816 1049458689 /nfs/dbraw/zinc/45/86/89/1049458689.db2.gz AYTKFKBZAFSOHL-NSHDSACASA-N 0 3 313.332 4.066 20 5 DIBDHN O=[N+]([O-])c1ccc(F)cc1CN1CC[C@H](C2CCCCC2)C1 ZINC001195885475 1049585821 /nfs/dbraw/zinc/58/58/21/1049585821.db2.gz XSGIPQGZSXVPDY-AWEZNQCLSA-N 0 3 306.381 4.136 20 5 DIBDHN Cc1cccc(C)c1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774258745 1049637890 /nfs/dbraw/zinc/63/78/90/1049637890.db2.gz SYTVLIWMPDMGJS-IBGZPJMESA-N 0 3 310.397 4.379 20 5 DIBDHN CCN(Cc1ccc(OC)cc1)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000488495470 1049661719 /nfs/dbraw/zinc/66/17/19/1049661719.db2.gz QEKOTIRHQSLVML-AWEZNQCLSA-N 0 3 314.385 4.187 20 5 DIBDHN CN(Cc1ccnn1C)Cc1c2ccccc2cc2ccccc21 ZINC001206355216 1049718990 /nfs/dbraw/zinc/71/89/90/1049718990.db2.gz MTKCGIUZJFZADV-UHFFFAOYSA-N 0 3 315.420 4.359 20 5 DIBDHN Cc1ccc(CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)s1 ZINC000489141075 1049729398 /nfs/dbraw/zinc/72/93/98/1049729398.db2.gz RPERMJKSSPEXBF-ZDUSSCGKSA-N 0 3 304.415 4.466 20 5 DIBDHN COc1ccc(CN2CC[C@@]2(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC001197241085 1049732165 /nfs/dbraw/zinc/73/21/65/1049732165.db2.gz YNZFPQYLUABSGZ-SFHVURJKSA-N 0 3 318.417 4.148 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H]1CCCc2sccc21 ZINC000574414471 1050455759 /nfs/dbraw/zinc/45/57/59/1050455759.db2.gz NHGUQBWDKYXEIR-GJZGRUSLSA-N 0 3 314.410 4.311 20 5 DIBDHN C[C@@H](F)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000574394328 1050457462 /nfs/dbraw/zinc/45/74/62/1050457462.db2.gz SIDSSZSETMCBPO-DYVFJYSZSA-N 0 3 302.349 4.022 20 5 DIBDHN C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000594046588 1050471334 /nfs/dbraw/zinc/47/13/34/1050471334.db2.gz WUAHEGBXBPPSLG-SNVBAGLBSA-N 0 3 316.323 4.038 20 5 DIBDHN Cc1cccc2c1CC[C@H]2N[C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000574583950 1050495525 /nfs/dbraw/zinc/49/55/25/1050495525.db2.gz RTHQUQPEAJGYLN-QZTJIDSGSA-N 0 3 308.381 4.168 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H]1CCCc2ccccc21 ZINC000594492319 1050516073 /nfs/dbraw/zinc/51/60/73/1050516073.db2.gz NLPKPHKXGJESLJ-MSOLQXFVSA-N 0 3 308.381 4.249 20 5 DIBDHN Cc1ccccc1C1(N[C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1 ZINC000594506869 1050521454 /nfs/dbraw/zinc/52/14/54/1050521454.db2.gz GAIRLPVCCMPVNU-QGZVFWFLSA-N 0 3 308.381 4.169 20 5 DIBDHN CC[C@@H](NCc1cc(COC)cs1)c1cccc([N+](=O)[O-])c1 ZINC000594935715 1050576604 /nfs/dbraw/zinc/57/66/04/1050576604.db2.gz GZSWOIDEMFIKKF-MRXNPFEDSA-N 0 3 320.414 4.044 20 5 DIBDHN C[C@@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000788498284 1050692976 /nfs/dbraw/zinc/69/29/76/1050692976.db2.gz MWBVRBNHTADUOC-GHMZBOCLSA-N 0 3 319.792 4.242 20 5 DIBDHN C[C@@H](NCc1ccc2ccccc2c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788563865 1050704118 /nfs/dbraw/zinc/70/41/18/1050704118.db2.gz OFDKNYXPGBBMSG-CYBMUJFWSA-N 0 3 321.380 4.181 20 5 DIBDHN Cc1cc(C)cc([C@@H](C)N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788596680 1050711223 /nfs/dbraw/zinc/71/12/23/1050711223.db2.gz ZZKQMQZAPHZJFQ-UONOGXRCSA-N 0 3 313.401 4.206 20 5 DIBDHN CC[C@H](NCc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000037010566 1051105171 /nfs/dbraw/zinc/10/51/71/1051105171.db2.gz JNVXXHQPLIJZAX-INIZCTEOSA-N 0 3 304.777 4.489 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CCC[C@@H]2CC2CCCC2)c(F)c1 ZINC001171632355 1051174844 /nfs/dbraw/zinc/17/48/44/1051174844.db2.gz YRVOAVNNZRXJDZ-OAHLLOKOSA-N 0 3 306.381 4.279 20 5 DIBDHN C[C@H](N[C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1c(Cl)cccc1Cl ZINC001168978360 1051475211 /nfs/dbraw/zinc/47/52/11/1051475211.db2.gz RHJBAVQIVYUDDS-HBNTYKKESA-N 0 3 317.216 4.089 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CC[C@@H](c3ccccc3)C2)cc1Cl ZINC000761506867 1051582834 /nfs/dbraw/zinc/58/28/34/1051582834.db2.gz OEPMPNMWVPIIHJ-OAHLLOKOSA-N 0 3 316.788 4.238 20 5 DIBDHN C[C@@H]1Cc2ccccc2[C@@H]1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522482 1051584772 /nfs/dbraw/zinc/58/47/72/1051584772.db2.gz ZCUODFGLUNDYPH-PIGZYNQJSA-N 0 3 316.788 4.271 20 5 DIBDHN Cc1cccc2c1CC[C@H]2NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519722 1051586697 /nfs/dbraw/zinc/58/66/97/1051586697.db2.gz GEGLXFORZCECAG-MRXNPFEDSA-N 0 3 316.788 4.334 20 5 DIBDHN CC(C)(NCc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC000761520703 1051586723 /nfs/dbraw/zinc/58/67/23/1051586723.db2.gz DRTUMPQVUPYRQI-UHFFFAOYSA-N 0 3 304.777 4.273 20 5 DIBDHN C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NCc1c(F)cccc1Cl ZINC001173213913 1051649947 /nfs/dbraw/zinc/64/99/47/1051649947.db2.gz LXNTXHGJWHYLFN-NSHDSACASA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000495401935 1052335785 /nfs/dbraw/zinc/33/57/85/1052335785.db2.gz OYAPOYPFDDWDKC-QWHCGFSZSA-N 0 3 302.349 4.016 20 5 DIBDHN COc1cccc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000193899970 1052511236 /nfs/dbraw/zinc/51/12/36/1052511236.db2.gz NPMPSEOWKVJQRW-OLZOCXBDSA-N 0 3 300.358 4.015 20 5 DIBDHN C[C@@H]1C[C@H](c2ccccc2)CN1Cc1csc([N+](=O)[O-])c1 ZINC000609672648 1052986626 /nfs/dbraw/zinc/98/66/26/1052986626.db2.gz NUUWLGIDODNSLW-DOMZBBRYSA-N 0 3 302.399 4.034 20 5 DIBDHN C[C@H](N[C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000619754177 1053548394 /nfs/dbraw/zinc/54/83/94/1053548394.db2.gz LUKXPAZBTFQZCU-ZBEGNZNMSA-N 0 3 302.399 4.385 20 5 DIBDHN O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1cccc(C(F)F)c1 ZINC001329941361 1054010822 /nfs/dbraw/zinc/01/08/22/1054010822.db2.gz PSTZCBRMJDASQX-HNNXBMFYSA-N 0 3 318.323 4.310 20 5 DIBDHN Cc1ccc([C@H](C)N[C@@H]2CCc3c2cccc3[N+](=O)[O-])s1 ZINC000848526947 1054127459 /nfs/dbraw/zinc/12/74/59/1054127459.db2.gz MNWJLWLKAKDJPH-SMDDNHRTSA-N 0 3 302.399 4.303 20 5 DIBDHN CCOc1cccc([C@@H](C)NCc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000131459355 1055742834 /nfs/dbraw/zinc/74/28/34/1055742834.db2.gz SEPPYNXXVBQEHC-CQSZACIVSA-N 0 3 314.385 4.153 20 5 DIBDHN CC[C@@H](C)N[C@H](CNc1cc(C)ccc1[N+](=O)[O-])c1ccco1 ZINC001612367592 1056278931 /nfs/dbraw/zinc/27/89/31/1056278931.db2.gz HMEDZCVRZCFPGZ-UKRRQHHQSA-N 0 3 317.389 4.038 20 5 DIBDHN Cc1cc(F)c(CNC[C@H](C)c2ccccc2[N+](=O)[O-])c(F)c1 ZINC001621086663 1056414438 /nfs/dbraw/zinc/41/44/38/1056414438.db2.gz LQNNWFNIIXGMAR-LBPRGKRZSA-N 0 3 320.339 4.075 20 5 DIBDHN CCC1CCC(N(C)Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC001615788073 1056575181 /nfs/dbraw/zinc/57/51/81/1056575181.db2.gz BKWRRPAWQBUBFL-UHFFFAOYSA-N 0 3 306.406 4.004 20 5 DIBDHN CCN(Cc1cccc([N+](=O)[O-])c1)[C@H](C)c1cccc(OC)c1 ZINC000113172338 1056691865 /nfs/dbraw/zinc/69/18/65/1056691865.db2.gz ZJIIEIQGIAWLPX-CQSZACIVSA-N 0 3 314.385 4.187 20 5 DIBDHN CCN(Cc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000113172333 1056692793 /nfs/dbraw/zinc/69/27/93/1056692793.db2.gz ZJIIEIQGIAWLPX-AWEZNQCLSA-N 0 3 314.385 4.187 20 5 DIBDHN C[C@H](c1cccc(O)c1)N(C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093315361 1057035749 /nfs/dbraw/zinc/03/57/49/1057035749.db2.gz UWGSTIYXRNIHQY-VIIAAUOXSA-N 0 3 312.369 4.007 20 5 DIBDHN CSC1(CNc2cc(C)nc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000302862522 1057112964 /nfs/dbraw/zinc/11/29/64/1057112964.db2.gz RGEYARSGQBWSIC-UHFFFAOYSA-N 0 3 317.414 4.149 20 5 DIBDHN Cc1ccccc1[C@H](NCc1ccc(C)c([N+](=O)[O-])c1)C1CC1 ZINC000732819881 1057788148 /nfs/dbraw/zinc/78/81/48/1057788148.db2.gz BTAYFAIWZXAOSD-LJQANCHMSA-N 0 3 310.397 4.453 20 5 DIBDHN Cc1ccc(F)cc1CN(Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC001559499339 1059285116 /nfs/dbraw/zinc/28/51/16/1059285116.db2.gz PPLNPWYNQOUDBQ-UHFFFAOYSA-N 0 3 316.376 4.453 20 5 DIBDHN C[C@H]1C[C@@H](c2ccccc2)CN1Cc1ccc(F)cc1[N+](=O)[O-] ZINC001559538976 1059340497 /nfs/dbraw/zinc/34/04/97/1059340497.db2.gz CJKRJADZMKZHMC-XJKSGUPXSA-N 0 3 314.360 4.112 20 5 DIBDHN CCCCN(CCCC)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC001559572317 1059405386 /nfs/dbraw/zinc/40/53/86/1059405386.db2.gz UUMXIGSXGNLIKI-UHFFFAOYSA-N 0 3 312.385 4.145 20 5 DIBDHN C[C@H](Cc1ccsc1)N(C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001559583602 1059415316 /nfs/dbraw/zinc/41/53/16/1059415316.db2.gz LMUNQQBPQWILCS-LLVKDONJSA-N 0 3 324.833 4.373 20 5 DIBDHN C[C@@H](CCN1CCc2ccc([N+](=O)[O-])cc2C1)c1ccccc1 ZINC001560697651 1060551323 /nfs/dbraw/zinc/55/13/23/1060551323.db2.gz JJGRYUALKZPKQP-HNNXBMFYSA-N 0 3 310.397 4.147 20 5 DIBDHN C[C@H]1C[C@H](C)CN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001560715446 1060574678 /nfs/dbraw/zinc/57/46/78/1060574678.db2.gz IKYAFKPDDIMSFZ-QWRGUYRKSA-N 0 3 316.323 4.092 20 5 DIBDHN C[C@H](CC1CCCCC1)NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC001560791081 1060651404 /nfs/dbraw/zinc/65/14/04/1060651404.db2.gz AMSICHQBRSPGHS-GFCCVEGCSA-N 0 3 317.389 4.185 20 5 DIBDHN Cc1cccc(CC2CN(Cc3c(C)ccc([N+](=O)[O-])c3C)C2)c1 ZINC001560942719 1060806396 /nfs/dbraw/zinc/80/63/96/1060806396.db2.gz DVVRYEVPYKPWBX-UHFFFAOYSA-N 0 3 324.424 4.195 20 5 DIBDHN CCO[C@@H]1C[C@H](N(C)Cc2ccccc2[N+](=O)[O-])C1(CC)CC ZINC001473243447 1061018613 /nfs/dbraw/zinc/01/86/13/1061018613.db2.gz KANSHPYGIORPIY-DLBZAZTESA-N 0 3 320.433 4.010 20 5 DIBDHN COc1ccc(CN2CCCC[C@H]2CCC(C)C)cc1[N+](=O)[O-] ZINC001473253483 1061031173 /nfs/dbraw/zinc/03/11/73/1061031173.db2.gz NXJAIOYMZLTDCL-INIZCTEOSA-N 0 3 320.433 4.394 20 5 DIBDHN CC(C)(C)SCCCN(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001473343921 1061103303 /nfs/dbraw/zinc/10/33/03/1061103303.db2.gz WPCWGLVDSLJADB-UHFFFAOYSA-N 0 3 322.474 4.481 20 5 DIBDHN CCN(Cc1cc([N+](=O)[O-])ccc1OC(C)C)CC1CCC1 ZINC001473417634 1061150129 /nfs/dbraw/zinc/15/01/29/1061150129.db2.gz KSFGYIOCZHEPSB-UHFFFAOYSA-N 0 3 306.406 4.004 20 5 DIBDHN CN(CCC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001473583373 1061270056 /nfs/dbraw/zinc/27/00/56/1061270056.db2.gz BIQJQMNKOODEIT-UHFFFAOYSA-N 0 3 318.339 4.482 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN1CCC[C@@H]1CC1CCCC1 ZINC001473595863 1061281118 /nfs/dbraw/zinc/28/11/18/1061281118.db2.gz PXNBWEXKXQUXIH-MRXNPFEDSA-N 0 3 306.381 4.279 20 5 DIBDHN C[C@H](c1ccccc1)[C@H]1CCCN1Cc1csc([N+](=O)[O-])c1 ZINC001473818834 1061423478 /nfs/dbraw/zinc/42/34/78/1061423478.db2.gz XGDJNHHLSQXEES-CZUORRHYSA-N 0 3 316.426 4.424 20 5 DIBDHN O=[N+]([O-])c1cc(F)ccc1CN(CC1CCCCC1)C1CC1 ZINC001459323540 1062090834 /nfs/dbraw/zinc/09/08/34/1062090834.db2.gz HLFDMPQZYANAEX-UHFFFAOYSA-N 0 3 306.381 4.279 20 5 DIBDHN CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2cc[nH]c2c1 ZINC001459346643 1062101132 /nfs/dbraw/zinc/10/11/32/1062101132.db2.gz SQFQNBYJNHGPOB-UHFFFAOYSA-N 0 3 323.396 4.487 20 5 DIBDHN C[C@H](Cc1ccccc1[N+](=O)[O-])NCc1ccc(Cl)cc1F ZINC001254538009 1062165518 /nfs/dbraw/zinc/16/55/18/1062165518.db2.gz MGCOLINXSPXGML-LLVKDONJSA-N 0 3 322.767 4.108 20 5 DIBDHN C[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001459512238 1062175991 /nfs/dbraw/zinc/17/59/91/1062175991.db2.gz FOGRVPBCFBZLGK-OSAQELSMSA-N 0 3 308.809 4.401 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1CCC=C(c2ccco2)C1 ZINC001474517005 1062201380 /nfs/dbraw/zinc/20/13/80/1062201380.db2.gz NIJHFBYJASWERX-UHFFFAOYSA-N 0 3 312.369 4.094 20 5 DIBDHN Cc1ccc([N+](=O)[O-])c(C)c1CN1Cc2ccccc2[C@@H](C)C1 ZINC001474696546 1062424012 /nfs/dbraw/zinc/42/40/12/1062424012.db2.gz LSEGBOXEYXZSJT-AWEZNQCLSA-N 0 3 310.397 4.331 20 5 DIBDHN COc1cc(CN2CCC[C@]2(C)CC(C)C)c([N+](=O)[O-])cc1F ZINC001460137473 1062655221 /nfs/dbraw/zinc/65/52/21/1062655221.db2.gz RNZCMGOOLQVDMO-QGZVFWFLSA-N 0 3 324.396 4.143 20 5 DIBDHN O=[N+]([O-])c1ccc(CN2CC[C@H](C3CCCCC3)C2)c(F)c1 ZINC001460372246 1062817956 /nfs/dbraw/zinc/81/79/56/1062817956.db2.gz YPEGHKFRNXVVAC-AWEZNQCLSA-N 0 3 306.381 4.136 20 5 DIBDHN CC1(C)CN(Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21 ZINC001460896047 1063122795 /nfs/dbraw/zinc/12/27/95/1063122795.db2.gz ODXHIEHTSPQIRF-DZGCQCFKSA-N 0 3 308.809 4.259 20 5 DIBDHN Cc1ccc(SCCN(C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC001472771063 1063220261 /nfs/dbraw/zinc/22/02/61/1063220261.db2.gz MPGNEGCJHGUTPU-UHFFFAOYSA-N 0 3 316.426 4.127 20 5 DIBDHN C[C@H](NCc1cc2ccncc2s1)c1cccc([N+](=O)[O-])c1 ZINC001461063576 1063227282 /nfs/dbraw/zinc/22/72/82/1063227282.db2.gz IIZIWFCJQVCSNU-NSHDSACASA-N 0 3 313.382 4.055 20 5 DIBDHN CC(C)N1CCCC[C@H]1CSc1ccc([N+](=O)[O-])cc1F ZINC001473014014 1063356630 /nfs/dbraw/zinc/35/66/30/1063356630.db2.gz LSQUGUVGSYAIAQ-ZDUSSCGKSA-N 0 3 312.410 4.089 20 5 DIBDHN CC(C)(NCc1ccc2[nH]ccc2c1)c1ccc([N+](=O)[O-])cc1 ZINC001462063633 1063910622 /nfs/dbraw/zinc/91/06/22/1063910622.db2.gz WDZLRUYGYYZLEN-UHFFFAOYSA-N 0 3 309.369 4.101 20 5 DIBDHN Cc1ccc(CN(Cc2cccc(F)c2)C(C)C)cc1[N+](=O)[O-] ZINC001307428024 1065387659 /nfs/dbraw/zinc/38/76/59/1065387659.db2.gz ACTQVKAOFVPIET-UHFFFAOYSA-N 0 3 316.376 4.453 20 5 DIBDHN Cc1ccccc1[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC001307444720 1065405549 /nfs/dbraw/zinc/40/55/49/1065405549.db2.gz YDUQWYVIQKYPAF-AWEZNQCLSA-N 0 3 314.360 4.032 20 5 DIBDHN C[C@]1(CCc2ccccc2)CCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC001307518500 1065457903 /nfs/dbraw/zinc/45/79/03/1065457903.db2.gz RDKREKLHBHUAEK-FQEVSTJZSA-N 0 3 324.424 4.440 20 5 DIBDHN CC[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@@H]1C ZINC001307703645 1065572333 /nfs/dbraw/zinc/57/23/33/1065572333.db2.gz WRKMWQOYPSDKNY-ZIAGYGMSSA-N 0 3 306.406 4.002 20 5 DIBDHN CCC1(CC)CCCN(Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC001307928946 1065687033 /nfs/dbraw/zinc/68/70/33/1065687033.db2.gz PFUFPADUYKXVKP-UHFFFAOYSA-N 0 3 306.406 4.006 20 5 DIBDHN Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC(F)(C2CC2)CC1 ZINC001308129522 1065773932 /nfs/dbraw/zinc/77/39/32/1065773932.db2.gz CQPKAOMELMNDQM-ZDUSSCGKSA-N 0 3 306.381 4.178 20 5 DIBDHN O=[N+]([O-])c1ccc(-c2ccc(CNC/C=C/Cl)s2)cc1 ZINC001308542395 1066059619 /nfs/dbraw/zinc/05/96/19/1066059619.db2.gz AOTQVJKKIOQRRF-UNXLUWIOSA-N 0 3 308.790 4.165 20 5 DIBDHN Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c([O-])c1 ZINC000903286954 1066103374 /nfs/dbraw/zinc/10/33/74/1066103374.db2.gz KDDQXSGDALCHPU-OLZOCXBDSA-N 0 3 300.358 4.021 20 5 DIBDHN C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC(C2CCCC2)C1 ZINC001308809599 1066287012 /nfs/dbraw/zinc/28/70/12/1066287012.db2.gz OBHPYBXJZBNIBX-NTEUORMPSA-N 0 3 300.402 4.120 20 5 DIBDHN