smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Oc1ccc(Cl)c2c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CC=C[C@H]21 ZINC000000054465 209392471 /nfs/dbraw/zinc/39/24/71/209392471.db2.gz HBESOAZVTUCMGT-OGHNNQOOSA-N 0 0 332.230 5.526 40 10 EKCBRN CCOc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1Cl)N2 ZINC000000094397 206211460 /nfs/dbraw/zinc/21/14/60/206211460.db2.gz OXQOEHFBIMXJJM-SIFCLUCFSA-N 0 0 325.839 5.565 40 10 EKCBRN Cc1cc(C=O)c(C)n1-c1c(Cl)cc(C(F)(F)F)cc1Cl ZINC000000165602 563249603 /nfs/dbraw/zinc/24/96/03/563249603.db2.gz IZOYFORQOPLAFD-UHFFFAOYSA-N 0 0 336.140 5.232 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@@H]21 ZINC000000180338 201445332 /nfs/dbraw/zinc/44/53/32/201445332.db2.gz JKDMOWOSUDQFLW-QEEYODRMSA-N 0 0 344.285 6.437 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@H]21 ZINC000000302459 209524166 /nfs/dbraw/zinc/52/41/66/209524166.db2.gz KBMHBMPVHXODCA-JKDFXYPNSA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1ccc([N+](=O)[O-])cc1)[C@H]1CC=C[C@@H]21 ZINC000000302473 564125178 /nfs/dbraw/zinc/12/51/78/564125178.db2.gz XRFOGCLJQPTYEP-VCBZYWHSSA-N 0 0 340.810 5.383 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3ccccc3[C@H]3C=CC[C@H]32)c1 ZINC000000302474 205427777 /nfs/dbraw/zinc/42/77/77/205427777.db2.gz FEBOSHKPJVMMLR-RVZJWNSFSA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 ZINC000000302475 201457950 /nfs/dbraw/zinc/45/79/50/201457950.db2.gz UCRPOEDVGWUPTC-KSMMKXTCSA-N 0 0 340.810 5.383 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3c(F)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000000302485 563996755 /nfs/dbraw/zinc/99/67/55/563996755.db2.gz VBHKJPDDOFQAHX-XWCIJXRUSA-N 0 0 344.773 5.214 40 10 EKCBRN Cc1ccc(/C=C2\C=C(c3ccc(C(C)C)cc3)OC2=O)cc1[N+](=O)[O-] ZINC000000320082 563996805 /nfs/dbraw/zinc/99/68/05/563996805.db2.gz JUYGAABYEHJHAR-VCHYOVAHSA-N 0 0 349.386 5.008 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000000445459 564012634 /nfs/dbraw/zinc/01/26/34/564012634.db2.gz LOKINRXCCWRUJB-DAYGRLMNSA-N 0 0 326.783 5.075 40 10 EKCBRN Brc1ccccc1[C@H]1Nc2ccccc2[C@H]2C=CC[C@H]21 ZINC000000972002 209697219 /nfs/dbraw/zinc/69/72/19/209697219.db2.gz BPTGFMCTVQMOHX-DFHBCGBQSA-N 0 0 326.237 5.276 40 10 EKCBRN Nc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000000975486 564002217 /nfs/dbraw/zinc/00/22/17/564002217.db2.gz BVWHDELMXLOWLL-VNBZBWLYSA-N 0 0 331.246 5.402 40 10 EKCBRN CC(=O)c1ccc(O)c2c1[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1)N2 ZINC000001300536 564001959 /nfs/dbraw/zinc/00/19/59/564001959.db2.gz XNLLUKGSUWZNBI-FCEWJHQRSA-N 0 0 339.822 5.075 40 10 EKCBRN Cc1ccc(/C=C2/SC(=S)N(c3ccc(C)c(C)c3)C2=O)cc1 ZINC000001416356 563388416 /nfs/dbraw/zinc/38/84/16/563388416.db2.gz FTECXPRLNJWMNX-GZTJUZNOSA-N 0 0 339.485 5.018 40 10 EKCBRN Fc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@@H]21 ZINC000001418691 209744037 /nfs/dbraw/zinc/74/40/37/209744037.db2.gz VAKKSMGEZXSCQP-RLFDGXBXSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@H]21 ZINC000001418693 206286224 /nfs/dbraw/zinc/28/62/24/206286224.db2.gz FJVYZNUTOQCQBB-PRXAMGSTSA-N 0 0 333.328 5.671 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c([C@H]2Nc3ccc(F)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000001461949 209752496 /nfs/dbraw/zinc/75/24/96/209752496.db2.gz AKDONNMSBGSFAF-LXIYXOSZSA-N 0 0 344.773 5.214 40 10 EKCBRN CCOc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1Cl)N2 ZINC000001461957 564003586 /nfs/dbraw/zinc/00/35/86/564003586.db2.gz OXQOEHFBIMXJJM-SXGZJXTBSA-N 0 0 325.839 5.565 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cc([N+](=O)[O-])ccc1Cl)N2 ZINC000001461963 564013044 /nfs/dbraw/zinc/01/30/44/564013044.db2.gz UCRPOEDVGWUPTC-LPMFXHHGSA-N 0 0 340.810 5.383 40 10 EKCBRN COc1ccc(-c2csc(=Nc3ccccc3)n2C(C)C)cc1 ZINC000001466371 563390602 /nfs/dbraw/zinc/39/06/02/563390602.db2.gz HGFOTGGLUOIAAI-UHFFFAOYSA-O 0 0 325.457 5.036 40 10 EKCBRN CC=C(c1ccc(N(CC)CC)cc1)c1ccc(N(CC)CC)cc1 ZINC000001594193 563395343 /nfs/dbraw/zinc/39/53/43/563395343.db2.gz XMXURSCAZOLQKH-UHFFFAOYSA-N 0 0 336.523 5.831 40 10 EKCBRN CCCCCCC(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC000001600260 201512686 /nfs/dbraw/zinc/51/26/86/201512686.db2.gz YGIZRIQLALIQCR-UHFFFAOYSA-N 0 0 338.539 5.921 40 10 EKCBRN CN(C)c1ccc(C(=Cc2ccccc2)c2ccc(N(C)C)cc2)cc1 ZINC000001600341 564096248 /nfs/dbraw/zinc/09/62/48/564096248.db2.gz HPEFUALZETVWQS-UHFFFAOYSA-N 0 0 342.486 5.408 40 10 EKCBRN CC(C)c1ccc(/C=C2\C=C(c3ccc4ccccc4c3)OC2=O)cc1 ZINC000001667461 564099041 /nfs/dbraw/zinc/09/90/41/564099041.db2.gz NTKKXMINIPBLPE-LPYMAVHISA-N 0 0 340.422 5.945 40 10 in-vitro EKCBRN CC(C)(C)c1cc(Br)c(O)c(CNc2ccccc2)c1 ZINC000001680954 563402770 /nfs/dbraw/zinc/40/27/70/563402770.db2.gz CEMWOIWYHCKGAD-UHFFFAOYSA-N 0 0 334.257 5.064 40 10 EKCBRN CN(C)c1ccc(/C=C2\c3ccccc3-c3ccc([N+](=O)[O-])cc32)cc1 ZINC000001686976 563403345 /nfs/dbraw/zinc/40/33/45/563403345.db2.gz XMNXSUPJEJGSMD-FYJGNVAPSA-N 0 0 342.398 5.230 40 10 EKCBRN CCN(CC)c1ccc(C(=S)c2ccc(N(CC)CC)cc2)cc1 ZINC000001688128 563403992 /nfs/dbraw/zinc/40/39/92/563403992.db2.gz VDNIJUWUEYQFTQ-UHFFFAOYSA-N 0 0 340.536 5.145 40 10 EKCBRN CCCCCn1nc(C)c(C2Nc3cccc4cccc(c43)N2)c1C ZINC000001740257 564002020 /nfs/dbraw/zinc/00/20/20/564002020.db2.gz QSGRAIJICFWQFQ-UHFFFAOYSA-N 0 0 334.467 5.380 40 10 EKCBRN CCn1c(-c2ccc(Cl)cc2)csc1=Nc1cccc(C)c1C ZINC000001878923 201522405 /nfs/dbraw/zinc/52/24/05/201522405.db2.gz XTPAZRMNSUKYIE-UHFFFAOYSA-O 0 0 343.903 5.736 40 10 EKCBRN CCn1c(-c2ccc(C)cc2)csc1=Nc1ccc(Cl)cc1 ZINC000001878927 563415191 /nfs/dbraw/zinc/41/51/91/563415191.db2.gz QUVSJMSSMNSCDP-UHFFFAOYSA-O 0 0 329.876 5.428 40 10 EKCBRN CCn1c(-c2ccc(C)cc2)csc1=Nc1c(C)cc(C)cc1C ZINC000001946688 564125229 /nfs/dbraw/zinc/12/52/29/564125229.db2.gz BFQKIUCPOZHCLR-UHFFFAOYSA-O 0 0 337.512 5.700 40 10 EKCBRN Cc1ccc(-c2csc(=Nc3ccccc3)n2-c2ccccc2)cc1 ZINC000002243779 564003794 /nfs/dbraw/zinc/00/37/94/564003794.db2.gz JAOOPBPXVXTCKA-UHFFFAOYSA-O 0 0 343.475 5.744 40 10 EKCBRN CCCCCCn1c(-c2ccccc2)csc1=Nc1ccccc1 ZINC000002676775 564003992 /nfs/dbraw/zinc/00/39/92/564003992.db2.gz XHCNCWPBQPUGMV-UHFFFAOYSA-O 0 0 337.512 6.027 40 10 EKCBRN O=C1S/C(=C\c2ccc(Cl)cc2)C(=S)N1c1ccccc1 ZINC000002711564 205624428 /nfs/dbraw/zinc/62/44/28/205624428.db2.gz PLTLHYIOUZJTTQ-UVTDQMKNSA-N 0 0 331.849 5.382 40 10 EKCBRN Cc1ccc([C@H](Nc2nccs2)c2ccc3ccccc3c2O)cc1 ZINC000003009383 209952372 /nfs/dbraw/zinc/95/23/72/209952372.db2.gz AQCFBHPMAKNYHW-IBGZPJMESA-N 0 0 346.455 5.512 40 10 EKCBRN Cc1ccc([C@@H](Nc2nccs2)c2ccc3ccccc3c2O)cc1 ZINC000003009386 201555049 /nfs/dbraw/zinc/55/50/49/201555049.db2.gz AQCFBHPMAKNYHW-LJQANCHMSA-N 0 0 346.455 5.512 40 10 EKCBRN c1sc(=Nc2ccccc2)n(Cc2ccccc2)c1-c1ccccc1 ZINC000003019143 563469897 /nfs/dbraw/zinc/46/98/97/563469897.db2.gz UPCXPYPKHNTCAE-UHFFFAOYSA-O 0 0 343.475 5.495 40 10 EKCBRN Cc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000003097226 564013536 /nfs/dbraw/zinc/01/35/36/564013536.db2.gz ZVATYNIUFRUSQL-FCEWJHQRSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1ccc([N+](=O)[O-])c2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000003636277 210069760 /nfs/dbraw/zinc/06/97/60/210069760.db2.gz RPWYODFGQXXUKX-ZRGWGRIASA-N 0 0 340.810 5.383 40 10 EKCBRN c1coc(Cn2c(-c3ccccc3)csc2=Nc2ccccc2)c1 ZINC000004058974 564004728 /nfs/dbraw/zinc/00/47/28/564004728.db2.gz XWPYBTBJWJOOAF-UHFFFAOYSA-O 0 0 333.436 5.088 40 10 EKCBRN Nc1n[nH]c(-c2ccc(Cl)cc2)c1N=Nc1ccccc1Cl ZINC000004086006 563493690 /nfs/dbraw/zinc/49/36/90/563493690.db2.gz MTUIYMWNSPAKHE-XUTLUUPISA-N 0 0 332.194 5.381 40 10 EKCBRN Nc1c(/N=N/c2ccccc2)c(-c2ccccc2)nn1-c1ccccc1 ZINC000004087500 210116665 /nfs/dbraw/zinc/11/66/65/210116665.db2.gz XZRBRYBEWLNSMA-WCWDXBQESA-N 0 0 339.402 5.537 40 10 EKCBRN COc1ccc(/N=N/c2ccc3ccccc3c2Br)cc1 ZINC000004100716 210119416 /nfs/dbraw/zinc/11/94/16/210119416.db2.gz OGGGRUDSDPMNND-FMQUCBEESA-N 0 0 341.208 6.026 40 10 EKCBRN Nc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000004112558 210123231 /nfs/dbraw/zinc/12/32/31/210123231.db2.gz MYYNCBWMQYJPGO-ZJNRKIDTSA-N 0 0 331.246 5.402 40 10 EKCBRN Nc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000004112561 210122957 /nfs/dbraw/zinc/12/29/57/210122957.db2.gz MYYNCBWMQYJPGO-VEVIJQCQSA-N 0 0 331.246 5.402 40 10 EKCBRN CCOc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccccc1Cl)N2 ZINC000004140484 210131569 /nfs/dbraw/zinc/13/15/69/210131569.db2.gz OXQOEHFBIMXJJM-AUSJPIAWSA-N 0 0 325.839 5.565 40 10 EKCBRN CCOc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1Cl)N2 ZINC000004140485 210131452 /nfs/dbraw/zinc/13/14/52/210131452.db2.gz OXQOEHFBIMXJJM-STXHMFSFSA-N 0 0 325.839 5.565 40 10 EKCBRN CCOc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccccc1Cl)N2 ZINC000004140486 210131222 /nfs/dbraw/zinc/13/12/22/210131222.db2.gz OXQOEHFBIMXJJM-BXTJHSDWSA-N 0 0 325.839 5.565 40 10 EKCBRN C1=C[C@H]2c3ccccc3N[C@@H](c3cccc(OC4CSC4)c3)[C@@H]2C1 ZINC000004151375 210132930 /nfs/dbraw/zinc/13/29/30/210132930.db2.gz YNTGJDVQAGJDTA-DSKINZAPSA-N 0 0 335.472 5.007 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c([N+](=O)[O-])cc(C)c(C)c3[C@H]3C=CC[C@H]32)cc1 ZINC000004151408 564129642 /nfs/dbraw/zinc/12/96/42/564129642.db2.gz PUHNXMQLZRMICU-QKLQHJQFSA-N 0 0 334.419 5.347 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c([N+](=O)[O-])cc(C)c(C)c3[C@H]3C=CC[C@@H]32)cc1 ZINC000004151410 564129651 /nfs/dbraw/zinc/12/96/51/564129651.db2.gz PUHNXMQLZRMICU-ZWOKBUDYSA-N 0 0 334.419 5.347 40 10 EKCBRN O=[N+]([O-])c1ccc([C@H]2Nc3c(Cl)cccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000004156791 201592280 /nfs/dbraw/zinc/59/22/80/201592280.db2.gz XYVREAVYUWSPEO-GRDNDAEWSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccc([C@H]2Nc3c(Cl)cccc3[C@H]3C=CC[C@H]32)cc1 ZINC000004156795 563496067 /nfs/dbraw/zinc/49/60/67/563496067.db2.gz XYVREAVYUWSPEO-JJRVBVJISA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@H]21 ZINC000004181764 564004887 /nfs/dbraw/zinc/00/48/87/564004887.db2.gz KBMHBMPVHXODCA-XWCIJXRUSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@@H]21 ZINC000004181767 210141184 /nfs/dbraw/zinc/14/11/84/210141184.db2.gz KBMHBMPVHXODCA-PRXAMGSTSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@@H]21 ZINC000004181769 205690645 /nfs/dbraw/zinc/69/06/45/205690645.db2.gz KBMHBMPVHXODCA-NVGCLXPQSA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1ccc([N+](=O)[O-])cc1)[C@H]1CC=C[C@H]21 ZINC000004183911 564026626 /nfs/dbraw/zinc/02/66/26/564026626.db2.gz XRFOGCLJQPTYEP-DOXZYTNZSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1ccc([N+](=O)[O-])cc1)[C@@H]1CC=C[C@H]21 ZINC000004183916 564026614 /nfs/dbraw/zinc/02/66/14/564026614.db2.gz XRFOGCLJQPTYEP-KHYOSLBOSA-N 0 0 340.810 5.383 40 10 EKCBRN CC(=O)c1ccc(O)c2c1[C@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1)N2 ZINC000004332023 210173227 /nfs/dbraw/zinc/17/32/27/210173227.db2.gz XNLLUKGSUWZNBI-BXWFABGCSA-N 0 0 339.822 5.075 40 10 EKCBRN Nc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000004348236 210178017 /nfs/dbraw/zinc/17/80/17/210178017.db2.gz BVWHDELMXLOWLL-IUUKEHGRSA-N 0 0 331.246 5.402 40 10 EKCBRN Nc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000004348237 210176910 /nfs/dbraw/zinc/17/69/10/210176910.db2.gz BVWHDELMXLOWLL-PZROIBLQSA-N 0 0 331.246 5.402 40 10 EKCBRN Nc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000004348239 210176953 /nfs/dbraw/zinc/17/69/53/210176953.db2.gz BVWHDELMXLOWLL-OAVHHTNSSA-N 0 0 331.246 5.402 40 10 EKCBRN COc1ccc2[nH+]c3cc(Cl)ccc3c(Nc3cccnc3)c2c1 ZINC000004366490 210180746 /nfs/dbraw/zinc/18/07/46/210180746.db2.gz LUUDYHCKONVRQY-UHFFFAOYSA-N 0 0 335.794 5.189 40 10 in-vivo EKCBRN O=C1N=C(Nc2ccc(Cl)cc2)SC1=Cc1cccc(Cl)c1 ZINC000004426172 210190221 /nfs/dbraw/zinc/19/02/21/210190221.db2.gz CTUCPMHEKMUNQP-ZROIWOOFSA-N 0 0 349.242 5.076 40 10 EKCBRN O=C1N=C(Nc2ccc(Cl)cc2)SC1=Cc1ccc(Cl)cc1 ZINC000004426175 210190989 /nfs/dbraw/zinc/19/09/89/210190989.db2.gz 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O=[N+]([O-])c1cccc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000004623290 210233530 /nfs/dbraw/zinc/23/35/30/210233530.db2.gz QOIJPAQWTJOHSL-CKEIUWERSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cccc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000004623291 210233819 /nfs/dbraw/zinc/23/38/19/210233819.db2.gz QOIJPAQWTJOHSL-JKIFEVAISA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000004713379 210256288 /nfs/dbraw/zinc/25/62/88/210256288.db2.gz ZVATYNIUFRUSQL-BXWFABGCSA-N 0 0 340.264 5.584 40 10 EKCBRN O=[N+]([O-])c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000004718506 210258578 /nfs/dbraw/zinc/25/85/78/210258578.db2.gz ONJUTHIWGVUHNE-HDMKZQKVSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccc2c(c1)[C@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1)N2 ZINC000004718507 210258099 /nfs/dbraw/zinc/25/80/99/210258099.db2.gz ONJUTHIWGVUHNE-DAYGRLMNSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccc2c(c1)[C@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2 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/nfs/dbraw/zinc/56/44/99/563564499.db2.gz BDITUEXWDHOJFJ-MPGHIAIKSA-N 0 0 340.810 5.383 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(F)cc(F)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000006324073 564125891 /nfs/dbraw/zinc/12/58/91/564125891.db2.gz IWNUEZBTQIZNSA-QKLQHJQFSA-N 0 0 339.429 6.089 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000006324087 564125892 /nfs/dbraw/zinc/12/58/92/564125892.db2.gz CRWHCJBYGMSYQE-UEXGIBASSA-N 0 0 337.894 6.464 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3ccc([N+](=O)[O-])cc3[C@H]3C=CC[C@H]32)cc1 ZINC000006324093 564125877 /nfs/dbraw/zinc/12/58/77/564125877.db2.gz WIIBDLVLCILWFT-UEXGIBASSA-N 0 0 348.446 5.719 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)cccc3[C@H]3C=CC[C@H]32)cc1 ZINC000006324104 564125895 /nfs/dbraw/zinc/12/58/95/564125895.db2.gz YSMZVRGYUNOZES-QKLQHJQFSA-N 0 0 337.894 6.464 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(cccc3[N+](=O)[O-])[C@H]3C=CC[C@H]32)cc1 ZINC000006324108 564125869 /nfs/dbraw/zinc/12/58/69/564125869.db2.gz 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YGERKLPLLHBMDC-WFXMLNOXSA-N 0 0 334.419 5.292 40 10 EKCBRN CCc1ccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006943629 563993648 /nfs/dbraw/zinc/99/36/48/563993648.db2.gz ZRAOADWHLOUMSP-ZWOKBUDYSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(C)c(C(=O)OC)ccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006943673 564126271 /nfs/dbraw/zinc/12/62/71/564126271.db2.gz RCBPDMMUWLMOCC-IPJJNNNSSA-N 0 0 347.458 5.171 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@@H]32)cc1 ZINC000006943691 564126275 /nfs/dbraw/zinc/12/62/75/564126275.db2.gz DAAWXZHTYYZPFN-BXWFABGCSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000006943914 564126258 /nfs/dbraw/zinc/12/62/58/564126258.db2.gz DADDUHAYNSSTBF-SIFCLUCFSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000006943937 563993688 /nfs/dbraw/zinc/99/36/88/563993688.db2.gz XUWXYHSBSSCURJ-QEEYODRMSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000006943957 563993664 /nfs/dbraw/zinc/99/36/64/563993664.db2.gz ABXYIXFQCGWGNI-LAPQFRIASA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006943978 563993659 /nfs/dbraw/zinc/99/36/59/563993659.db2.gz LDVSISJNFFENMD-QEEYODRMSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000006944000 563993658 /nfs/dbraw/zinc/99/36/58/563993658.db2.gz DADDUHAYNSSTBF-SXGZJXTBSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1Cl)N2 ZINC000006944024 563993687 /nfs/dbraw/zinc/99/36/87/563993687.db2.gz XUWXYHSBSSCURJ-STXHMFSFSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000006944044 563993681 /nfs/dbraw/zinc/99/36/81/563993681.db2.gz ABXYIXFQCGWGNI-ARGWCVDVSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006944063 563993665 /nfs/dbraw/zinc/99/36/65/563993665.db2.gz LDVSISJNFFENMD-STXHMFSFSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000006944765 564126269 /nfs/dbraw/zinc/12/62/69/564126269.db2.gz ZYOSNOKLQQTJQL-PTSWNOGYSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@H]21 ZINC000006944794 564126274 /nfs/dbraw/zinc/12/62/74/564126274.db2.gz RQAVFWBJOKADEC-IIMJZQEZSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@H]21 ZINC000006944818 564126262 /nfs/dbraw/zinc/12/62/62/564126262.db2.gz BGRULYLJWHWHBB-AFBRZQFHSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@H]21 ZINC000006944842 564126251 /nfs/dbraw/zinc/12/62/51/564126251.db2.gz BKUKMNFOAQWQKU-IIMJZQEZSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CC=C[C@H]21 ZINC000006944863 564126264 /nfs/dbraw/zinc/12/62/64/564126264.db2.gz ZYOSNOKLQQTJQL-AKCHCHLHSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@@H]1CC=C[C@H]21 ZINC000006944890 564126265 /nfs/dbraw/zinc/12/62/65/564126265.db2.gz RQAVFWBJOKADEC-KKVAFCGZSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@H]21 ZINC000006944911 563993666 /nfs/dbraw/zinc/99/36/66/563993666.db2.gz BGRULYLJWHWHBB-RCDCFZSISA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@H]21 ZINC000006944935 564126257 /nfs/dbraw/zinc/12/62/57/564126257.db2.gz BKUKMNFOAQWQKU-KKVAFCGZSA-N 0 0 343.392 6.094 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000006954201 564015095 /nfs/dbraw/zinc/01/50/95/564015095.db2.gz UZHGAKDYGWGITB-QHRIQVFBSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006954210 564126328 /nfs/dbraw/zinc/12/63/28/564126328.db2.gz JFAGLZABTTXQKF-BIENJYKASA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000006954225 564015142 /nfs/dbraw/zinc/01/51/42/564015142.db2.gz UZHGAKDYGWGITB-VLXJIEOASA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006954235 564126319 /nfs/dbraw/zinc/12/63/19/564126319.db2.gz JFAGLZABTTXQKF-PJIJBLCYSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@H]3C=CC[C@H]32)c1 ZINC000006954608 564126316 /nfs/dbraw/zinc/12/63/16/564126316.db2.gz OIVDMALOADVGGF-FCEWJHQRSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@H]32)c1 ZINC000006954617 564126309 /nfs/dbraw/zinc/12/63/09/564126309.db2.gz ZOLHHARSBGUCGN-DAYGRLMNSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000006954626 564126331 /nfs/dbraw/zinc/12/63/31/564126331.db2.gz OIVDMALOADVGGF-BXWFABGCSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@@H]32)c1 ZINC000006954632 564126337 /nfs/dbraw/zinc/12/63/37/564126337.db2.gz ZOLHHARSBGUCGN-MPGHIAIKSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000006954825 564126330 /nfs/dbraw/zinc/12/63/30/564126330.db2.gz AAIIZNBFPYTRHH-ZJNRKIDTSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@H]21 ZINC000006954834 564126333 /nfs/dbraw/zinc/12/63/33/564126333.db2.gz VALWTPIONXDUMR-LXIYXOSZSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CC=C[C@H]21 ZINC000006954838 564126323 /nfs/dbraw/zinc/12/63/23/564126323.db2.gz AAIIZNBFPYTRHH-VEVIJQCQSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@H]21 ZINC000006954848 564126324 /nfs/dbraw/zinc/12/63/24/564126324.db2.gz VALWTPIONXDUMR-JCGVRSQUSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@H]2C=CC[C@H]21 ZINC000006955656 564126329 /nfs/dbraw/zinc/12/63/29/564126329.db2.gz OWNVRYSLEXSWJQ-IQUTYRLHSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@H]2C=CC[C@H]21 ZINC000006955667 564126338 /nfs/dbraw/zinc/12/63/38/564126338.db2.gz UVIJTESVECERER-VEVIJQCQSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@H]2C=CC[C@@H]21 ZINC000006955685 564126322 /nfs/dbraw/zinc/12/63/22/564126322.db2.gz OWNVRYSLEXSWJQ-CKFHNAJUSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@H]2C=CC[C@@H]21 ZINC000006955696 564126315 /nfs/dbraw/zinc/12/63/15/564126315.db2.gz UVIJTESVECERER-ZJNRKIDTSA-N 0 0 345.364 5.541 40 10 EKCBRN Cc1cc(-c2nc3ccccc3s2)c(C)n1-c1ccc(Cl)cc1 ZINC000006961650 564015267 /nfs/dbraw/zinc/01/52/67/564015267.db2.gz NMBNFMSPPJYYBS-UHFFFAOYSA-N 0 0 338.863 6.024 40 10 EKCBRN Cc1cc(-c2nc3ccccc3s2)c(C)n1-c1ccc(N(C)C)cc1 ZINC000006961719 564126420 /nfs/dbraw/zinc/12/64/20/564126420.db2.gz DPISEKIVKHQVMY-UHFFFAOYSA-N 0 0 347.487 5.437 40 10 EKCBRN Cc1cc(-c2nc3ccccc3s2)c(C)n1-c1ccc([N+](=O)[O-])cc1 ZINC000006961883 564126434 /nfs/dbraw/zinc/12/64/34/564126434.db2.gz CNAZNTBKXFTVMB-UHFFFAOYSA-N 0 0 349.415 5.279 40 10 EKCBRN Cc1cc(-c2nc3ccccc3s2)c(C)n1-c1ccc2c(c1)OCO2 ZINC000006961928 564126433 /nfs/dbraw/zinc/12/64/33/564126433.db2.gz XHKMMAJWWIZUHF-UHFFFAOYSA-N 0 0 348.427 5.100 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@H]21 ZINC000006962646 257865220 /nfs/dbraw/zinc/86/52/20/257865220.db2.gz CVHGTFHKJMDSPF-YRVVQQKDSA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@H]21 ZINC000006962653 564126464 /nfs/dbraw/zinc/12/64/64/564126464.db2.gz YNWKTZSODGXJPZ-AVYPCKFXSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@H]21 ZINC000006962662 564015272 /nfs/dbraw/zinc/01/52/72/564015272.db2.gz CVHGTFHKJMDSPF-MNVSYLFESA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@H]21 ZINC000006962669 564126457 /nfs/dbraw/zinc/12/64/57/564126457.db2.gz YNWKTZSODGXJPZ-MDOVXXIYSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000006962713 257865049 /nfs/dbraw/zinc/86/50/49/257865049.db2.gz GDKBNKSMMDICMP-LAPQFRIASA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006962721 563994145 /nfs/dbraw/zinc/99/41/45/563994145.db2.gz GEVLJELTOZVTGW-QEEYODRMSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1Cl)N2 ZINC000006962739 564015269 /nfs/dbraw/zinc/01/52/69/564015269.db2.gz GDKBNKSMMDICMP-ARGWCVDVSA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006962746 563994139 /nfs/dbraw/zinc/99/41/39/563994139.db2.gz GEVLJELTOZVTGW-STXHMFSFSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2 ZINC000006962806 564015302 /nfs/dbraw/zinc/01/53/02/564015302.db2.gz ITHRBPDEIDRBSG-GJYPPUQNSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(F)c1)N2 ZINC000006962810 564126441 /nfs/dbraw/zinc/12/64/41/564126441.db2.gz PTPKBGAIRBMCOK-GJYPPUQNSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1F)N2 ZINC000006962822 564015307 /nfs/dbraw/zinc/01/53/07/564015307.db2.gz OXUZNLHCHBBKQR-BIENJYKASA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1)N2 ZINC000006962842 564126452 /nfs/dbraw/zinc/12/64/52/564126452.db2.gz ITHRBPDEIDRBSG-MDZRGWNJSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@H]1[C@H](c1cccc(F)c1)N2 ZINC000006962845 564126447 /nfs/dbraw/zinc/12/64/47/564126447.db2.gz PTPKBGAIRBMCOK-MDZRGWNJSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1F)N2 ZINC000006962858 564126468 /nfs/dbraw/zinc/12/64/68/564126468.db2.gz OXUZNLHCHBBKQR-PJIJBLCYSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccc(C(C)C)cc1)[C@H]1CC=C[C@H]21 ZINC000006963478 564015298 /nfs/dbraw/zinc/01/52/98/564015298.db2.gz DAAKVIHLYVAONQ-CNNODRBYSA-N 0 0 348.446 5.853 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@H]21 ZINC000006963480 564015319 /nfs/dbraw/zinc/01/53/19/564015319.db2.gz KSMYSCWVYCPUTL-TXPKVOOTSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000006963486 257865215 /nfs/dbraw/zinc/86/52/15/257865215.db2.gz YUDDPQBUMAOMEO-TXPKVOOTSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21 ZINC000006963499 564015316 /nfs/dbraw/zinc/01/53/16/564015316.db2.gz DQIGGDHUJDKSCI-NJSLBKSFSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccc(C(C)C)cc1)[C@@H]1CC=C[C@H]21 ZINC000006963512 564015296 /nfs/dbraw/zinc/01/52/96/564015296.db2.gz DAAKVIHLYVAONQ-NNMXDRDESA-N 0 0 348.446 5.853 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CC=C[C@H]21 ZINC000006963514 564015306 /nfs/dbraw/zinc/01/53/06/564015306.db2.gz KSMYSCWVYCPUTL-FRQCXROJSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@H]21 ZINC000006963520 257865349 /nfs/dbraw/zinc/86/53/49/257865349.db2.gz YUDDPQBUMAOMEO-FRQCXROJSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21 ZINC000006963533 564015294 /nfs/dbraw/zinc/01/52/94/564015294.db2.gz DQIGGDHUJDKSCI-KSMMKXTCSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000006966455 564126487 /nfs/dbraw/zinc/12/64/87/564126487.db2.gz BACGYYGUFCUIRE-FCEWJHQRSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000006966456 564126486 /nfs/dbraw/zinc/12/64/86/564126486.db2.gz MMLBRMONMFCDPB-FBLLAGFSSA-N 0 0 337.466 6.489 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@H]32)cc1 ZINC000006966459 564129666 /nfs/dbraw/zinc/12/96/66/564129666.db2.gz UACQIXPDFBOADR-DAYGRLMNSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006966463 564126488 /nfs/dbraw/zinc/12/64/88/564126488.db2.gz BACGYYGUFCUIRE-BXWFABGCSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006966464 564126494 /nfs/dbraw/zinc/12/64/94/564126494.db2.gz MMLBRMONMFCDPB-HWBMXIPRSA-N 0 0 337.466 6.489 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@@H]32)cc1 ZINC000006966467 564126515 /nfs/dbraw/zinc/12/65/15/564126515.db2.gz UACQIXPDFBOADR-MPGHIAIKSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1cc([C@@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(C)cc1 ZINC000006966499 564126521 /nfs/dbraw/zinc/12/65/21/564126521.db2.gz AVWBRVPNFSXHGY-OAQYLSRUSA-N 0 0 347.487 5.099 40 10 EKCBRN Cc1cc([C@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccc(C)cc1 ZINC000006966500 564126513 /nfs/dbraw/zinc/12/65/13/564126513.db2.gz AVWBRVPNFSXHGY-NRFANRHFSA-N 0 0 347.487 5.099 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000006967021 564015314 /nfs/dbraw/zinc/01/53/14/564015314.db2.gz GYMNOOSLNOCKHR-TYILLQQXSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006967024 564126528 /nfs/dbraw/zinc/12/65/28/564126528.db2.gz SXYMNJNQNIZTGX-BIENJYKASA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000006967026 564015299 /nfs/dbraw/zinc/01/52/99/564015299.db2.gz GYMNOOSLNOCKHR-LPMFXHHGSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000006967029 564126516 /nfs/dbraw/zinc/12/65/16/564126516.db2.gz SXYMNJNQNIZTGX-PJIJBLCYSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc2c(c1C)N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@H]21 ZINC000006967084 257865145 /nfs/dbraw/zinc/86/51/45/257865145.db2.gz XXOISNXVPYLOOM-YRVVQQKDSA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1ccc2c(c1C)N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@H]21 ZINC000006967088 563994236 /nfs/dbraw/zinc/99/42/36/563994236.db2.gz CLAMKTUZNRAEJA-AVYPCKFXSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1ccc2c(c1C)N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@H]21 ZINC000006967097 564015308 /nfs/dbraw/zinc/01/53/08/564015308.db2.gz XXOISNXVPYLOOM-MNVSYLFESA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1ccc2c(c1C)N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@H]21 ZINC000006967101 563994246 /nfs/dbraw/zinc/99/42/46/563994246.db2.gz CLAMKTUZNRAEJA-MDOVXXIYSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1cc([C@@H]2NN=C(c3ccccc3)S2)c(C)n1-c1cccc(C)c1 ZINC000006967815 564126509 /nfs/dbraw/zinc/12/65/09/564126509.db2.gz CYCZMSQVPHTNHV-OAQYLSRUSA-N 0 0 347.487 5.099 40 10 EKCBRN Cc1cc([C@H]2NN=C(c3ccccc3)S2)c(C)n1-c1cccc(C)c1 ZINC000006967817 564126503 /nfs/dbraw/zinc/12/65/03/564126503.db2.gz CYCZMSQVPHTNHV-NRFANRHFSA-N 0 0 347.487 5.099 40 10 EKCBRN Cc1cc(-c2nc3ccccc3s2)c(C)n1-c1c(C)cccc1C ZINC000006968552 564126529 /nfs/dbraw/zinc/12/65/29/564126529.db2.gz OZQXPJFPUYAYKC-UHFFFAOYSA-N 0 0 332.472 5.988 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC=C[C@H]21 ZINC000006968652 563994250 /nfs/dbraw/zinc/99/42/50/563994250.db2.gz MJSOHUMANNVPFL-FRIZHTMISA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@H]21 ZINC000006968655 563994244 /nfs/dbraw/zinc/99/42/44/563994244.db2.gz RQLIEBFPAKXTTQ-HHXXYDBFSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@H]21 ZINC000006968661 563994254 /nfs/dbraw/zinc/99/42/54/563994254.db2.gz YHWZSPFORQQEOH-UHYGZKCKSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@H]21 ZINC000006968665 563994251 /nfs/dbraw/zinc/99/42/51/563994251.db2.gz FMOSKNHXZVNOLL-WTANOLMUSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@H]21 ZINC000006968669 563994240 /nfs/dbraw/zinc/99/42/40/563994240.db2.gz IIFXGXUGZVTJEC-WTANOLMUSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CC=C[C@H]21 ZINC000006968676 563994235 /nfs/dbraw/zinc/99/42/35/563994235.db2.gz MJSOHUMANNVPFL-ZXYWRSMDSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@H]21 ZINC000006968680 563994230 /nfs/dbraw/zinc/99/42/30/563994230.db2.gz RQLIEBFPAKXTTQ-SZVBFZGTSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@H]21 ZINC000006968686 563994238 /nfs/dbraw/zinc/99/42/38/563994238.db2.gz YHWZSPFORQQEOH-TVZGQMOCSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@H]21 ZINC000006968690 563994243 /nfs/dbraw/zinc/99/42/43/563994243.db2.gz FMOSKNHXZVNOLL-MUKKUYKPSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@H]21 ZINC000006968694 563994268 /nfs/dbraw/zinc/99/42/68/563994268.db2.gz IIFXGXUGZVTJEC-MUKKUYKPSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1cc([C@@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccccc1C ZINC000006969367 564126518 /nfs/dbraw/zinc/12/65/18/564126518.db2.gz NRLAIOPPRDXQOM-OAQYLSRUSA-N 0 0 347.487 5.099 40 10 EKCBRN Cc1cc([C@H]2NN=C(c3ccccc3)S2)c(C)n1-c1ccccc1C ZINC000006969369 564126524 /nfs/dbraw/zinc/12/65/24/564126524.db2.gz NRLAIOPPRDXQOM-NRFANRHFSA-N 0 0 347.487 5.099 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@H]21 ZINC000006970014 564126535 /nfs/dbraw/zinc/12/65/35/564126535.db2.gz RUYVZZCYGDKTSJ-JJRVBVJISA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000006970021 564126555 /nfs/dbraw/zinc/12/65/55/564126555.db2.gz RUYVZZCYGDKTSJ-GRDNDAEWSA-N 0 0 349.783 6.185 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@H]32)c1 ZINC000006970105 564126559 /nfs/dbraw/zinc/12/65/59/564126559.db2.gz HDJQUGUPWOYXIM-DAYGRLMNSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@H]3C=CC[C@H]32)c1 ZINC000006970107 564126538 /nfs/dbraw/zinc/12/65/38/564126538.db2.gz IWBGPKNYDIIHGU-DAYGRLMNSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000006970112 563994280 /nfs/dbraw/zinc/99/42/80/563994280.db2.gz FYAHHTVADVIBRK-VBQJREDUSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@H]32)c1 ZINC000006970114 563994271 /nfs/dbraw/zinc/99/42/71/563994271.db2.gz XTSMZNZYPVJSOT-VBQJREDUSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(Br)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000006970118 563994279 /nfs/dbraw/zinc/99/42/79/563994279.db2.gz HDJQUGUPWOYXIM-MPGHIAIKSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000006970121 563994264 /nfs/dbraw/zinc/99/42/64/563994264.db2.gz IWBGPKNYDIIHGU-MPGHIAIKSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@@H]32)c1 ZINC000006970126 563994258 /nfs/dbraw/zinc/99/42/58/563994258.db2.gz FYAHHTVADVIBRK-ZQIUZPCESA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@@H]32)c1 ZINC000006970128 563994263 /nfs/dbraw/zinc/99/42/63/563994263.db2.gz XTSMZNZYPVJSOT-ZQIUZPCESA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000006971328 257865007 /nfs/dbraw/zinc/86/50/07/257865007.db2.gz YDGZALBXLXGXFA-ZQIUZPCESA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(Br)cccc3[C@H]3C=CC[C@H]32)cc1 ZINC000006971352 564015324 /nfs/dbraw/zinc/01/53/24/564015324.db2.gz YDGZALBXLXGXFA-VBQJREDUSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@@H]32)cc1 ZINC000006971389 564126549 /nfs/dbraw/zinc/12/65/49/564126549.db2.gz QXJRKJHNTLAZRD-ZQIUZPCESA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@H]3C=CC[C@H]32)cc1 ZINC000006971404 564126552 /nfs/dbraw/zinc/12/65/52/564126552.db2.gz QXJRKJHNTLAZRD-VBQJREDUSA-N 0 0 333.328 5.671 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21 ZINC000007092541 564126562 /nfs/dbraw/zinc/12/65/62/564126562.db2.gz MKZPMYGXIWTRDV-JKDFXYPNSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21 ZINC000007092671 563994325 /nfs/dbraw/zinc/99/43/25/563994325.db2.gz MKZPMYGXIWTRDV-PRXAMGSTSA-N 0 0 349.783 6.185 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@H]2C=CC[C@H]21 ZINC000007092775 563595368 /nfs/dbraw/zinc/59/53/68/563595368.db2.gz FBIMYVXCMDIONZ-VEVIJQCQSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@H]2C=CC[C@H]21 ZINC000007092847 564126581 /nfs/dbraw/zinc/12/65/81/564126581.db2.gz KSTBWQDYGITTJK-XWCIJXRUSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@H]2C=CC[C@H]21 ZINC000007092911 564126578 /nfs/dbraw/zinc/12/65/78/564126578.db2.gz XVRQRZUYVRCPIU-XWCIJXRUSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@H]2C=CC[C@@H]21 ZINC000007093075 563994311 /nfs/dbraw/zinc/99/43/11/563994311.db2.gz FBIMYVXCMDIONZ-ZJNRKIDTSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@H]2C=CC[C@@H]21 ZINC000007093120 564015387 /nfs/dbraw/zinc/01/53/87/564015387.db2.gz KSTBWQDYGITTJK-NVGCLXPQSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@H]2C=CC[C@@H]21 ZINC000007093172 564126591 /nfs/dbraw/zinc/12/65/91/564126591.db2.gz XVRQRZUYVRCPIU-NVGCLXPQSA-N 0 0 333.328 5.671 40 10 EKCBRN Brc1cccc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21 ZINC000007096296 564015390 /nfs/dbraw/zinc/01/53/90/564015390.db2.gz CXGVSJUNEWDUKZ-JJRVBVJISA-N 0 0 326.237 5.276 40 10 EKCBRN Brc1cccc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21 ZINC000007096349 564015408 /nfs/dbraw/zinc/01/54/08/564015408.db2.gz CXGVSJUNEWDUKZ-GRDNDAEWSA-N 0 0 326.237 5.276 40 10 EKCBRN Fc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000007096703 564015388 /nfs/dbraw/zinc/01/53/88/564015388.db2.gz ITZUDXBPACTJRD-DPLHUUCSSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000007096747 564126570 /nfs/dbraw/zinc/12/65/70/564126570.db2.gz PUMVJXYEQJSHRZ-DPLHUUCSSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@@H]2C=CC[C@@H]21 ZINC000007096824 564015385 /nfs/dbraw/zinc/01/53/85/564015385.db2.gz TZZIQOIZIGLBPE-YDIMBITNSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000007096887 564126563 /nfs/dbraw/zinc/12/65/63/564126563.db2.gz ITZUDXBPACTJRD-LGVFNWMJSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000007096930 564126590 /nfs/dbraw/zinc/12/65/90/564126590.db2.gz PUMVJXYEQJSHRZ-LGVFNWMJSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@@H]2C=CC[C@H]21 ZINC000007096996 564126572 /nfs/dbraw/zinc/12/65/72/564126572.db2.gz TZZIQOIZIGLBPE-KHCICDEESA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000007097066 564126566 /nfs/dbraw/zinc/12/65/66/564126566.db2.gz ITZUDXBPACTJRD-HFMPRLQTSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000007097096 564126574 /nfs/dbraw/zinc/12/65/74/564126574.db2.gz PUMVJXYEQJSHRZ-HFMPRLQTSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@H]2C=CC[C@@H]21 ZINC000007097156 564126586 /nfs/dbraw/zinc/12/65/86/564126586.db2.gz TZZIQOIZIGLBPE-AXHZCLLHSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000007097221 564126593 /nfs/dbraw/zinc/12/65/93/564126593.db2.gz ITZUDXBPACTJRD-IMSXRSKXSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@H]3C=CC[C@H]32)c1 ZINC000007097256 564126609 /nfs/dbraw/zinc/12/66/09/564126609.db2.gz PUMVJXYEQJSHRZ-IMSXRSKXSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(-c3ccccc3)cc2[C@H]2C=CC[C@H]21 ZINC000007097317 564126617 /nfs/dbraw/zinc/12/66/17/564126617.db2.gz TZZIQOIZIGLBPE-XLNZFTOWSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000007097641 564126619 /nfs/dbraw/zinc/12/66/19/564126619.db2.gz CTJQJNQDWWSJDB-FUDKSRODSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@@H]32)c1 ZINC000007097658 564126618 /nfs/dbraw/zinc/12/66/18/564126618.db2.gz MZLAPNHWIUXPHX-FUDKSRODSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(-c3ccccc3)cccc2[C@H]2C=CC[C@@H]21 ZINC000007097695 564126621 /nfs/dbraw/zinc/12/66/21/564126621.db2.gz UDASVPTYZHGHNG-LJFZDNNRSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@H]32)cc1 ZINC000007097723 564126616 /nfs/dbraw/zinc/12/66/16/564126616.db2.gz CTJQJNQDWWSJDB-XJUOHMSHSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@H]3C=CC[C@H]32)c1 ZINC000007097747 564126610 /nfs/dbraw/zinc/12/66/10/564126610.db2.gz MZLAPNHWIUXPHX-XJUOHMSHSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(-c3ccccc3)cccc2[C@H]2C=CC[C@H]21 ZINC000007097778 564126600 /nfs/dbraw/zinc/12/66/00/564126600.db2.gz UDASVPTYZHGHNG-DRMXPCRNSA-N 0 0 341.429 6.319 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccccc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000007098176 564015404 /nfs/dbraw/zinc/01/54/04/564015404.db2.gz ZRLFFZYGBOWOLT-YEWDVWPNSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccccc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000007098193 564015397 /nfs/dbraw/zinc/01/53/97/564015397.db2.gz ZRLFFZYGBOWOLT-WRSAYESZSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccccc3[C@H]3C=CC[C@@H]32)ccc1Cl ZINC000007098204 564015406 /nfs/dbraw/zinc/01/54/06/564015406.db2.gz ZRLFFZYGBOWOLT-IAISJRAMSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccccc3[C@H]3C=CC[C@H]32)ccc1Cl ZINC000007098210 564015425 /nfs/dbraw/zinc/01/54/25/564015425.db2.gz ZRLFFZYGBOWOLT-DFHBCGBQSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2c3ccccc3ccc2[C@H]2C=CC[C@@H]21 ZINC000007098989 564015432 /nfs/dbraw/zinc/01/54/32/564015432.db2.gz LBMLQITUMYNDTG-PNLZDCPESA-N 0 0 342.398 5.575 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2c3ccccc3ccc2[C@H]2C=CC[C@H]21 ZINC000007099006 564015416 /nfs/dbraw/zinc/01/54/16/564015416.db2.gz LBMLQITUMYNDTG-GSHUGGBRSA-N 0 0 342.398 5.575 40 10 EKCBRN Cc1ccc(C)n1-c1ccc(C(=O)Nc2cccc(Cl)c2C)cc1 ZINC000007468129 564126706 /nfs/dbraw/zinc/12/67/06/564126706.db2.gz GZWUJTMUDUDBGE-UHFFFAOYSA-N 0 0 338.838 5.308 40 10 EKCBRN Cc1ccc(C)n1-c1cccc(C(=O)Nc2cccc(Cl)c2C)c1 ZINC000007468135 564126696 /nfs/dbraw/zinc/12/66/96/564126696.db2.gz ZXISYQZILPRJKW-UHFFFAOYSA-N 0 0 338.838 5.308 40 10 EKCBRN Cc1ccc(C)n1-c1ccccc1C(=O)Nc1cccc(Cl)c1C ZINC000007468138 564126694 /nfs/dbraw/zinc/12/66/94/564126694.db2.gz UXNIBZSAJRUNCE-UHFFFAOYSA-N 0 0 338.838 5.308 40 10 EKCBRN Cc1ccc(C)n1-c1ccc(C(=O)Nc2cc(Cl)ccc2C)cc1 ZINC000007468142 564126690 /nfs/dbraw/zinc/12/66/90/564126690.db2.gz RJSHCTLUBNVUGC-UHFFFAOYSA-N 0 0 338.838 5.308 40 10 EKCBRN Cc1ccc(C)n1-c1cccc(C(=O)Nc2cc(Cl)ccc2C)c1 ZINC000007468146 564126686 /nfs/dbraw/zinc/12/66/86/564126686.db2.gz HVQFVSMWWXMNQE-UHFFFAOYSA-N 0 0 338.838 5.308 40 10 EKCBRN Cc1ccc(C)n1-c1ccccc1C(=O)Nc1cc(Cl)ccc1C ZINC000007468149 564126698 /nfs/dbraw/zinc/12/66/98/564126698.db2.gz ISKFBZRCZRMDLV-UHFFFAOYSA-N 0 0 338.838 5.308 40 10 EKCBRN CCc1cccc(CC)c1NC(=O)c1ccc(-n2c(C)ccc2C)cc1 ZINC000007468151 564126705 /nfs/dbraw/zinc/12/67/05/564126705.db2.gz ORICOVHXCFCWBP-UHFFFAOYSA-N 0 0 346.474 5.471 40 10 EKCBRN CCc1cccc(CC)c1NC(=O)c1ccccc1-n1c(C)ccc1C ZINC000007468154 563994631 /nfs/dbraw/zinc/99/46/31/563994631.db2.gz UUSSJAULXWWLHA-UHFFFAOYSA-N 0 0 346.474 5.471 40 10 EKCBRN Cc1ccc(C)n1-c1ccc(Oc2ccc(Cl)cc2Cl)cc1 ZINC000007468540 564126714 /nfs/dbraw/zinc/12/67/14/564126714.db2.gz YWRRYDMTIIYYNX-UHFFFAOYSA-N 0 0 332.230 6.193 40 10 EKCBRN CCc1ccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@H]3C=CC[C@H]32)cc1 ZINC000008087369 564127059 /nfs/dbraw/zinc/12/70/59/564127059.db2.gz ULIJJUQFYSLWEE-YRNRMSPPSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@H]3C=CC[C@H]32)cc1 ZINC000008087375 564127068 /nfs/dbraw/zinc/12/70/68/564127068.db2.gz KRAHTRWGCRSXBT-KHYOSLBOSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@H]32)cc1 ZINC000008087380 564127075 /nfs/dbraw/zinc/12/70/75/564127075.db2.gz KWNDRZWYSBJIJA-FCEWJHQRSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@H]32)cc1 ZINC000008087397 563996039 /nfs/dbraw/zinc/99/60/39/563996039.db2.gz GUWAUZSWBMUJSI-KHYOSLBOSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@H]3C=CC[C@@H]32)cc1 ZINC000008087409 563996051 /nfs/dbraw/zinc/99/60/51/563996051.db2.gz ULIJJUQFYSLWEE-FTRWYGJKSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@H]3C=CC[C@@H]32)cc1 ZINC000008087419 564127100 /nfs/dbraw/zinc/12/71/00/564127100.db2.gz KRAHTRWGCRSXBT-DOXZYTNZSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000008087425 564127085 /nfs/dbraw/zinc/12/70/85/564127085.db2.gz KWNDRZWYSBJIJA-BXWFABGCSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000008087447 564127088 /nfs/dbraw/zinc/12/70/88/564127088.db2.gz GUWAUZSWBMUJSI-DOXZYTNZSA-N 0 0 344.285 6.382 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@H]21 ZINC000008115858 564127132 /nfs/dbraw/zinc/12/71/32/564127132.db2.gz GUBWJSHDWVKGDJ-SUNYJGFJSA-N 0 0 329.802 5.314 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21 ZINC000008115883 564127125 /nfs/dbraw/zinc/12/71/25/564127125.db2.gz OCVGPVLFGQBNSX-PZROIBLQSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@H]21 ZINC000008115924 564127134 /nfs/dbraw/zinc/12/71/34/564127134.db2.gz GUBWJSHDWVKGDJ-PMUMKWKESA-N 0 0 329.802 5.314 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21 ZINC000008115950 563996341 /nfs/dbraw/zinc/99/63/41/563996341.db2.gz OCVGPVLFGQBNSX-IUUKEHGRSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@H]3C=CC[C@H]32)c1 ZINC000008168387 564016062 /nfs/dbraw/zinc/01/60/62/564016062.db2.gz FOUXZTFOXLIZCI-KHYOSLBOSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@H]3C=CC[C@H]32)c1 ZINC000008168395 564016071 /nfs/dbraw/zinc/01/60/71/564016071.db2.gz NCVJEFCEEDKRDR-IYOUNJFTSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@H]3C=CC[C@@H]32)c1 ZINC000008168428 564016066 /nfs/dbraw/zinc/01/60/66/564016066.db2.gz FOUXZTFOXLIZCI-DOXZYTNZSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@H]3C=CC[C@@H]32)c1 ZINC000008168445 564016070 /nfs/dbraw/zinc/01/60/70/564016070.db2.gz NCVJEFCEEDKRDR-DEYYWGMASA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@H]32)c1OC ZINC000008168986 564127156 /nfs/dbraw/zinc/12/71/56/564127156.db2.gz NONUBNFJDDEJJJ-IQUTYRLHSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)cccc3[C@H]3C=CC[C@H]32)c1OC ZINC000008168989 563996472 /nfs/dbraw/zinc/99/64/72/563996472.db2.gz KTLFVBOSIPJKMS-VEVIJQCQSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@H]3C=CC[C@@H]32)c1OC ZINC000008168999 564127166 /nfs/dbraw/zinc/12/71/66/564127166.db2.gz NONUBNFJDDEJJJ-CKFHNAJUSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)cccc3[C@H]3C=CC[C@@H]32)c1OC ZINC000008169002 564127154 /nfs/dbraw/zinc/12/71/54/564127154.db2.gz KTLFVBOSIPJKMS-ZJNRKIDTSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2cc(Cl)cc(Cl)c2[C@H]2C=CC[C@H]21 ZINC000008169405 257863264 /nfs/dbraw/zinc/86/32/64/257863264.db2.gz UCKDJCCDVSIOLB-XEKQOVJPSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(Cl)ccc(Cl)c2[C@H]2C=CC[C@H]21 ZINC000008169407 257863275 /nfs/dbraw/zinc/86/32/75/257863275.db2.gz WTFHVSQCLCMTMD-VNBZBWLYSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2cc(Cl)cc(Cl)c2[C@H]2C=CC[C@@H]21 ZINC000008169414 257863372 /nfs/dbraw/zinc/86/33/72/257863372.db2.gz UCKDJCCDVSIOLB-WTOJCKNJSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(Cl)ccc(Cl)c2[C@H]2C=CC[C@@H]21 ZINC000008169416 564016081 /nfs/dbraw/zinc/01/60/81/564016081.db2.gz WTFHVSQCLCMTMD-OAVHHTNSSA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1c(Cl)ccc2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@H]21 ZINC000008276534 564016035 /nfs/dbraw/zinc/01/60/35/564016035.db2.gz KNELOOYDIZEVJM-YZVOILCLSA-N 0 0 330.258 6.128 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/nfs/dbraw/zinc/01/60/51/564016051.db2.gz SOWPDFUJTZCUGX-QUJCMNEKSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1c(Cl)ccc2c1N[C@H](c1ccccc1[N+](=O)[O-])[C@@H]1CC=C[C@H]21 ZINC000008276856 564016044 /nfs/dbraw/zinc/01/60/44/564016044.db2.gz SNOLWMYPGNJCNT-QUJCMNEKSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc(C(C)C)cc1)[C@H]1CC=C[C@H]21 ZINC000008336056 563997490 /nfs/dbraw/zinc/99/74/90/563997490.db2.gz PADBRLDYNQFHRI-CNNODRBYSA-N 0 0 337.894 6.598 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@H]21 ZINC000008336057 563997482 /nfs/dbraw/zinc/99/74/82/563997482.db2.gz TTWBDPRUKCQTGC-TXPKVOOTSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc([N+](=O)[O-])cc1)[C@H]1CC=C[C@H]21 ZINC000008336060 563997477 /nfs/dbraw/zinc/99/74/77/563997477.db2.gz QVSLMHWONDMOKI-TXPKVOOTSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000008336063 563997479 /nfs/dbraw/zinc/99/74/79/563997479.db2.gz IGYGTCPQRYWSBI-TXPKVOOTSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc([N+](=O)[O-])c1)[C@H]1CC=C[C@H]21 ZINC000008336066 563997526 /nfs/dbraw/zinc/99/75/26/563997526.db2.gz FLKFTUMRESLJJL-TXPKVOOTSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc3ccccc31)[C@H]1CC=C[C@H]21 ZINC000008336069 564127204 /nfs/dbraw/zinc/12/72/04/564127204.db2.gz SZBBPTVFVLCXGA-GREBRCKQSA-N 0 0 345.873 6.628 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21 ZINC000008336074 564127256 /nfs/dbraw/zinc/12/72/56/564127256.db2.gz CFOKWBYRLKCLIJ-NJSLBKSFSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccccc1[N+](=O)[O-])[C@H]1CC=C[C@H]21 ZINC000008336077 564127241 /nfs/dbraw/zinc/12/72/41/564127241.db2.gz XSCPUKDKUIHBLI-NJSLBKSFSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc(C(C)C)cc1)[C@@H]1CC=C[C@H]21 ZINC000008336086 564127244 /nfs/dbraw/zinc/12/72/44/564127244.db2.gz PADBRLDYNQFHRI-NNMXDRDESA-N 0 0 337.894 6.598 40 10 EKCBRN 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ZINC000016216894 211888964 /nfs/dbraw/zinc/88/89/64/211888964.db2.gz AMXIUJRZDRVNLN-LTGZKZEYSA-N 0 0 345.467 5.566 40 10 EKCBRN COc1ccc(NC=CC(=S)c2ccc(C(C)(C)C)cc2)cc1 ZINC000016323171 211896910 /nfs/dbraw/zinc/89/69/10/211896910.db2.gz BRILFQMXDWLWKK-BUHFOSPRSA-N 0 0 325.477 5.337 40 10 EKCBRN CC1(C)Cc2c(cc(-c3ccccc3)n2-c2cccc(Cl)c2)C(=O)C1 ZINC000016605245 563817133 /nfs/dbraw/zinc/81/71/33/563817133.db2.gz QOGZVVOWWHDZGT-UHFFFAOYSA-N 0 0 349.861 5.953 40 10 EKCBRN CC(C=C1SC(Nc2ccc(C)cc2C)=NC1=O)=Cc1ccccc1 ZINC000016661551 211926348 /nfs/dbraw/zinc/92/63/48/211926348.db2.gz PDFYMQPBFCWICH-CAOIWOLBSA-N 0 0 348.471 5.332 40 10 EKCBRN CC(C=C1SC(Nc2cccc(C)c2)=NC1=O)=Cc1ccccc1 ZINC000016666185 563819778 /nfs/dbraw/zinc/81/97/78/563819778.db2.gz KIBXIHOXVUEGOI-YAIVMUPMSA-N 0 0 334.444 5.024 40 10 EKCBRN O=C1/C(=C\c2ccccc2)SC(=S)N1c1cccc2ccccc21 ZINC000016887820 564024739 /nfs/dbraw/zinc/02/47/39/564024739.db2.gz LSKKIFFKZRYXTM-QGOAFFKASA-N 0 0 347.464 5.246 40 10 EKCBRN 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/nfs/dbraw/zinc/84/61/19/563846119.db2.gz BDPMBHISELKTSQ-YEUCEMRASA-N 0 0 332.363 5.846 40 10 EKCBRN c1ccc(/N=N/c2ccc(Nc3nc4ccccc4s3)cc2)cc1 ZINC000017951202 563846223 /nfs/dbraw/zinc/84/62/23/563846223.db2.gz SOMCPFZQSDWBLK-GHVJWSGMSA-N 0 0 330.416 6.455 40 10 EKCBRN Brc1cccc(/N=N/c2cccc(Br)c2)c1 ZINC000017968697 211976788 /nfs/dbraw/zinc/97/67/88/211976788.db2.gz VEVQNDVHZNOSHX-FOCLMDBBSA-N 0 0 340.018 5.627 40 10 EKCBRN COc1cc(-c2ccc(NN=C3C=CC(=O)C=C3)c(OC)c2)ccc1N ZINC000018011114 563847030 /nfs/dbraw/zinc/84/70/30/563847030.db2.gz KTJMRHBUIPWLRP-GHVJWSGMSA-N 0 0 349.390 5.074 40 10 EKCBRN O=C1c2c3ccccc3ccc2-c2ccccc2C1=NNc1ccccc1 ZINC000018059006 563847461 /nfs/dbraw/zinc/84/74/61/563847461.db2.gz FPYVIHBFSAEKPV-OCEACIFDSA-N 0 0 348.405 7.267 40 10 EKCBRN CCc1ccc(/N=N/c2c(F)c(F)c(N(C)C)c(F)c2F)cc1 ZINC000018069010 563847860 /nfs/dbraw/zinc/84/78/60/563847860.db2.gz WURNNCUOZCORLT-QURGRASLSA-N 0 0 325.309 5.287 40 10 EKCBRN c1ccc(/N=N/C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1 ZINC000018088078 563848257 /nfs/dbraw/zinc/84/82/57/563848257.db2.gz YFMFSCRSAWIWOP-CYYJNZCTSA-N 0 0 348.449 6.762 40 10 EKCBRN CCc1ccc(/N=N/c2ccc(-c3ccc(NC(C)=O)cc3)cc2)cc1 ZINC000018097127 563848774 /nfs/dbraw/zinc/84/87/74/563848774.db2.gz NXVVPPAUEPHMJZ-OCOZRVBESA-N 0 0 343.430 6.290 40 10 EKCBRN c1ccc(-c2ccc(/N=N/c3ccc(-c4ccccc4)cc3)cc2)cc1 ZINC000018098834 563848793 /nfs/dbraw/zinc/84/87/93/563848793.db2.gz KXXMEJSOPZIZAD-OCEACIFDSA-N 0 0 334.422 7.436 40 10 EKCBRN Brc1ccc(/N=N/c2ccc(Br)cc2)cc1 ZINC000018100532 563848614 /nfs/dbraw/zinc/84/86/14/563848614.db2.gz LTPLLZWVPBTAMH-FOCLMDBBSA-N 0 0 340.018 5.627 40 10 EKCBRN c1ccc(Cc2[nH]nc(-c3ccccc3)c2N=Nc2ccccc2)cc1 ZINC000018101737 211982321 /nfs/dbraw/zinc/98/23/21/211982321.db2.gz PRIKJSKWEINIFC-WNAAXNPUSA-N 0 0 338.414 6.083 40 10 EKCBRN CN(C)c1ccc(/N=N/c2ccc3c4c(cccc42)-c2ccccc2-3)cc1 ZINC000018102015 563848771 /nfs/dbraw/zinc/84/87/71/563848771.db2.gz BCUQMDVAURETHX-OCEACIFDSA-N 0 0 349.437 6.969 40 10 EKCBRN 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EKCBRN Cc1ccccc1N=Nc1ccc(NN=C2C=CC(=O)C=C2)c(C)c1 ZINC000018252344 563851855 /nfs/dbraw/zinc/85/18/55/563851855.db2.gz NJMJSHLPJWODPM-LPRDPYTISA-N 0 0 330.391 6.840 40 10 EKCBRN O=C(Nc1ccc(Cl)cc1)Nc1c2ccccc2nc2ccccc21 ZINC000019015420 211996826 /nfs/dbraw/zinc/99/68/26/211996826.db2.gz MPTMBHZGUUOZIM-UHFFFAOYSA-N 0 0 347.805 5.685 40 10 EKCBRN O=C(Nc1cccc(Cl)c1)Nc1c2ccccc2nc2ccccc21 ZINC000019015422 563853236 /nfs/dbraw/zinc/85/32/36/563853236.db2.gz GMHBGNXMMPBWGJ-UHFFFAOYSA-N 0 0 347.805 5.685 40 10 EKCBRN CCN(CC)c1ccc(CNc2ccc(Br)cc2C)cc1 ZINC000019233167 564025171 /nfs/dbraw/zinc/02/51/71/564025171.db2.gz QFEUARNYTNUOTA-UHFFFAOYSA-N 0 0 347.300 5.216 40 10 EKCBRN C(Nc1ccccc1)=C1Sc2ccccc2N=C1c1ccccc1 ZINC000019819378 212072157 /nfs/dbraw/zinc/07/21/57/212072157.db2.gz MTXGYYLJJTWLQR-HKWRFOASSA-N 0 0 328.440 5.867 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c([N+](=O)[O-])cc(C)c(C)c3[C@@H]3C=CC[C@H]32)cc1 ZINC000020058202 212098518 /nfs/dbraw/zinc/09/85/18/212098518.db2.gz 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/nfs/dbraw/zinc/39/47/04/213394704.db2.gz ZILPRMPPNAABLS-RIYZIHGNSA-N 0 0 331.198 5.283 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c([C@@H]2Nc3ccc(F)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000043769586 563973202 /nfs/dbraw/zinc/97/32/02/563973202.db2.gz AKDONNMSBGSFAF-SNUQEOBHSA-N 0 0 344.773 5.214 40 10 EKCBRN Fc1cccc2c1N[C@@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@@H]21 ZINC000043769718 563925924 /nfs/dbraw/zinc/92/59/24/563925924.db2.gz FJVYZNUTOQCQBB-PSTGCABASA-N 0 0 333.328 5.671 40 10 EKCBRN c1ccc2c(c1)ccc1c3nc4ccccc4nc3c3ccccc3c21 ZINC000045068494 564060971 /nfs/dbraw/zinc/06/09/71/564060971.db2.gz OHRWCBOROPHUNE-UHFFFAOYSA-N 0 0 330.390 6.243 40 10 EKCBRN Fc1cccc(Cl)c1[C@@H]1Nc2ccc(Cl)cc2[C@@H]2C=CC[C@@H]21 ZINC000058850592 564050317 /nfs/dbraw/zinc/05/03/17/564050317.db2.gz CAMIKJRMSWQDPL-FTLABTOESA-N 0 0 334.221 5.959 40 10 EKCBRN CSc1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058850596 564050322 /nfs/dbraw/zinc/05/03/22/564050322.db2.gz RRWOCPHFEXOOPF-GJYPPUQNSA-N 0 0 327.880 5.888 40 10 EKCBRN Fc1cccc(Cl)c1[C@@H]1Nc2c(Cl)cccc2[C@@H]2C=CC[C@@H]21 ZINC000058850728 564050339 /nfs/dbraw/zinc/05/03/39/564050339.db2.gz JXEVDMSTRZUZSI-KWFDTGPKSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1Br)N2 ZINC000058850807 564050309 /nfs/dbraw/zinc/05/03/09/564050309.db2.gz ALBLFGDPHYUUOA-FHSNZYRGSA-N 0 0 344.227 5.415 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1c(F)cccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000058850887 257853524 /nfs/dbraw/zinc/85/35/24/257853524.db2.gz PBROEBAWFJBRPM-UYSIFFEZSA-N 0 0 348.248 6.267 40 10 EKCBRN CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1c(F)cccc1Cl)N2 ZINC000058850956 564050312 /nfs/dbraw/zinc/05/03/12/564050312.db2.gz DJQWILJEFJIQQA-LAPQFRIASA-N 0 0 341.813 5.508 40 10 EKCBRN O=[N+]([O-])c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1c(F)cccc1Cl)N2 ZINC000058850976 564050327 /nfs/dbraw/zinc/05/03/27/564050327.db2.gz OPXWQAXOSANMTP-FTLABTOESA-N 0 0 344.773 5.214 40 10 EKCBRN CSc1ccc([C@@H]2Nc3ccc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058850980 564050323 /nfs/dbraw/zinc/05/03/23/564050323.db2.gz FGZDSVVZQGCJLJ-GJYPPUQNSA-N 0 0 338.432 5.143 40 10 EKCBRN Fc1cccc(Cl)c1[C@@H]1Nc2c3ccccc3ccc2[C@@H]2C=CC[C@@H]21 ZINC000058851019 564050328 /nfs/dbraw/zinc/05/03/28/564050328.db2.gz MISVXKKHLYLUQH-ZMPRRUGASA-N 0 0 349.836 6.459 40 10 EKCBRN Cc1cccc2c1N[C@@H](c1ccc(OC3CSC3)cc1)[C@H]1CC=C[C@@H]21 ZINC000058928521 564050387 /nfs/dbraw/zinc/05/03/87/564050387.db2.gz OEGBGGXGQYSVRB-VCOUNFBDSA-N 0 0 349.499 5.316 40 10 EKCBRN COc1ccc([C@@H]2Nc3c(C)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058928611 564050399 /nfs/dbraw/zinc/05/03/99/564050399.db2.gz LUMHJDYPCVSPDR-GUXCAODWSA-N 0 0 325.839 5.484 40 10 EKCBRN CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(C(C)C)cc1)N2 ZINC000058928644 564050409 /nfs/dbraw/zinc/05/04/09/564050409.db2.gz XCNFZWXCAJFXSU-QTEQDKRBSA-N 0 0 331.459 5.839 40 10 EKCBRN CCOc1ccc([C@@H]2Nc3ccc(C(C)=O)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058928648 564050417 /nfs/dbraw/zinc/05/04/17/564050417.db2.gz KLIBYGWIRMZVEU-DXIQSLLYSA-N 0 0 333.431 5.114 40 10 EKCBRN CC(=O)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(OC(C)C)cc1)N2 ZINC000058928658 564050405 /nfs/dbraw/zinc/05/04/05/564050405.db2.gz UMCNBJHXBCNAAK-QTEQDKRBSA-N 0 0 347.458 5.503 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1F)N2 ZINC000058928927 257851129 /nfs/dbraw/zinc/85/11/29/257851129.db2.gz OXUZNLHCHBBKQR-TYILLQQXSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1)N2 ZINC000058928936 564050406 /nfs/dbraw/zinc/05/04/06/564050406.db2.gz ITHRBPDEIDRBSG-JTDSTZFVSA-N 0 0 338.382 5.177 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1)N2 ZINC000058928999 564050400 /nfs/dbraw/zinc/05/04/00/564050400.db2.gz WIQDDCQTFLPECL-IIYDPXPESA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2 ZINC000058929002 257850981 /nfs/dbraw/zinc/85/09/81/257850981.db2.gz WIQDDCQTFLPECL-IGCXYCKISA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058929007 257851101 /nfs/dbraw/zinc/85/11/01/257851101.db2.gz FQKTVOPZWNGMLL-GLJUWKHASA-N 0 0 340.810 5.383 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1F)N2 ZINC000058929018 257851016 /nfs/dbraw/zinc/85/10/16/257851016.db2.gz WFPGZINONMCWQD-RLFDGXBXSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1F)N2 ZINC000058929020 564050393 /nfs/dbraw/zinc/05/03/93/564050393.db2.gz WFPGZINONMCWQD-VGTOOOLASA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1)N2 ZINC000058929023 564050421 /nfs/dbraw/zinc/05/04/21/564050421.db2.gz WEZLBKIVUDIZDD-IIYDPXPESA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2 ZINC000058929029 257851198 /nfs/dbraw/zinc/85/11/98/257851198.db2.gz WEZLBKIVUDIZDD-IGCXYCKISA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cccc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000058929320 564050391 /nfs/dbraw/zinc/05/03/91/564050391.db2.gz UNEOWVZKSSJVKI-PEBVRCNWSA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000058929391 564050410 /nfs/dbraw/zinc/05/04/10/564050410.db2.gz MMLBRMONMFCDPB-SLSDLSHTSA-N 0 0 337.466 6.489 40 10 EKCBRN CCN(CC)c1ccc(-c2nc3cc(-c4ccccc4)ccc3o2)cc1 ZINC000059022451 564065494 /nfs/dbraw/zinc/06/54/94/564065494.db2.gz NASNPMNNPYLBBT-UHFFFAOYSA-N 0 0 342.442 6.008 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000059267050 214614364 /nfs/dbraw/zinc/61/43/64/214614364.db2.gz LOQFRSMQFWDUQO-GLJUWKHASA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1ccc(C2=C/C(=C\c3c(Cl)cccc3Cl)C(=O)O2)cc1C ZINC000059425569 564050721 /nfs/dbraw/zinc/05/07/21/564050721.db2.gz SQTRCPHWWQCDAY-NTEUORMPSA-N 0 0 345.225 5.592 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3cc(Cl)ccc3[C@H]3C=CC[C@H]32)cc1 ZINC000059475113 257849963 /nfs/dbraw/zinc/84/99/63/257849963.db2.gz KCWJVGZGANKSEN-KYJSFNMBSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3cc(Cl)ccc3[C@H]3C=CC[C@@H]32)cc1 ZINC000059475115 257850041 /nfs/dbraw/zinc/85/00/41/257850041.db2.gz KCWJVGZGANKSEN-HFTRVMKXSA-N 0 0 326.783 5.075 40 10 EKCBRN CCCCCC1(c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O ZINC000059500748 564050875 /nfs/dbraw/zinc/05/08/75/564050875.db2.gz WUKNMXPSYARZTO-UHFFFAOYSA-N 0 0 326.823 5.237 40 10 EKCBRN CCC1(c2ccc(-c3ccccc3)cc2)C(=O)c2ccccc2C1=O ZINC000059500831 564050877 /nfs/dbraw/zinc/05/08/77/564050877.db2.gz QWRXFQKEIHHXAV-UHFFFAOYSA-N 0 0 326.395 5.081 40 10 EKCBRN Cc1ccccc1/C=C1/SC(=S)N(c2cccc(Cl)c2)C1=O ZINC000059502983 564050864 /nfs/dbraw/zinc/05/08/64/564050864.db2.gz RDVYWWYOBXEZLA-OQLLNIDSSA-N 0 0 345.876 5.054 40 10 EKCBRN Fc1cccc2c1N[C@@H](c1ccccc1Br)[C@@H]1CC=C[C@@H]21 ZINC000066319766 202884161 /nfs/dbraw/zinc/88/41/61/202884161.db2.gz JXXTVJTZLCBGMT-PSTGCABASA-N 0 0 344.227 5.415 40 10 EKCBRN COc1c2ccccc2c2nc3ccccc3nc2c1C(C)(C)C(C)C ZINC000068601963 215322221 /nfs/dbraw/zinc/32/22/21/215322221.db2.gz FKGZYYVXWSHGFI-UHFFFAOYSA-N 0 0 344.458 5.878 40 10 EKCBRN COc1ccc2ccccc2c1C1Nc2cccc3cccc(c32)N1 ZINC000070453934 564136148 /nfs/dbraw/zinc/13/61/48/564136148.db2.gz BTGDYXFQQFVSCI-UHFFFAOYSA-N 0 0 326.399 5.538 40 10 EKCBRN COc1cc(C2Nc3cccc4cccc(c43)N2)ccc1OC(C)C ZINC000070453935 564136151 /nfs/dbraw/zinc/13/61/51/564136151.db2.gz JVHFGFFQBIPUCF-UHFFFAOYSA-N 0 0 334.419 5.172 40 10 EKCBRN CCCOc1ccc(C2Nc3cccc4cccc(c43)N2)cc1OC ZINC000070453936 564136172 /nfs/dbraw/zinc/13/61/72/564136172.db2.gz TZPFJSHKWKXUQO-UHFFFAOYSA-N 0 0 334.419 5.173 40 10 EKCBRN Cc1cc(C2Nc3cccc4cccc(c43)N2)c(C)n1Cc1ccco1 ZINC000070453949 564136168 /nfs/dbraw/zinc/13/61/68/564136168.db2.gz KLWJITIQPAAHAL-UHFFFAOYSA-N 0 0 343.430 5.436 40 10 EKCBRN FC(F)Oc1ccc(Cl)cc1C1Nc2cccc3cccc(c32)N1 ZINC000070453958 564136167 /nfs/dbraw/zinc/13/61/67/564136167.db2.gz OGCVZJPDECXZOL-UHFFFAOYSA-N 0 0 346.764 5.631 40 10 EKCBRN Cc1nn(-c2ccc(F)cc2)cc1C1Nc2cccc3cccc(c32)N1 ZINC000070453960 564136188 /nfs/dbraw/zinc/13/61/88/564136188.db2.gz IRDBFTFSGIANKD-UHFFFAOYSA-N 0 0 344.393 5.009 40 10 EKCBRN CCCOc1c(OCC)cccc1C1Nc2cccc3cccc(c32)N1 ZINC000070453965 564136184 /nfs/dbraw/zinc/13/61/84/564136184.db2.gz IVCWLDUNNGNSJU-UHFFFAOYSA-N 0 0 348.446 5.564 40 10 EKCBRN CCCCOc1cc(C2Nc3cccc4cccc(c43)N2)ccc1OC ZINC000070453966 564136169 /nfs/dbraw/zinc/13/61/69/564136169.db2.gz MTJIEGPIGCOWLN-UHFFFAOYSA-N 0 0 348.446 5.564 40 10 EKCBRN FC(F)(F)Oc1ccc(C2Nc3cccc4cccc(c43)N2)cc1 ZINC000070453988 564136179 /nfs/dbraw/zinc/13/61/79/564136179.db2.gz PZUXWYADBJEMTE-UHFFFAOYSA-N 0 0 330.309 5.275 40 10 EKCBRN Cc1c2cc(Cl)cc(Cl)c2oc(=O)c1C1=CC=CCC1=S ZINC000071404978 563934043 /nfs/dbraw/zinc/93/40/43/563934043.db2.gz ZTHYBVLPRRUSHU-UHFFFAOYSA-N 0 0 337.227 5.121 40 10 EKCBRN O=C1C=CC(=NNc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)C=C1 ZINC000095351622 218286271 /nfs/dbraw/zinc/28/62/71/218286271.db2.gz GDVLXNQFILRYQG-OCOZRVBESA-N 0 0 340.386 5.865 40 10 EKCBRN Cc1cc(/N=N\c2ccccc2)c(C(C)C)cc1/N=N\c1ccccc1 ZINC000096168944 563980016 /nfs/dbraw/zinc/98/00/16/563980016.db2.gz AOCSNOPVOYYRAN-YPAXQUSRSA-N 0 0 342.446 7.949 40 10 EKCBRN Cc1cc(/N=N\c2ccccc2)c(C(C)C)cc1/N=N/c1ccccc1 ZINC000096168945 563980009 /nfs/dbraw/zinc/98/00/09/563980009.db2.gz AOCSNOPVOYYRAN-MRAZZECGSA-N 0 0 342.446 7.949 40 10 EKCBRN Cc1cc(/N=N/c2ccccc2)c(C(C)C)cc1/N=N/c1ccccc1 ZINC000096168946 563980008 /nfs/dbraw/zinc/98/00/08/563980008.db2.gz AOCSNOPVOYYRAN-OGGGYYITSA-N 0 0 342.446 7.949 40 10 EKCBRN O=[N+]([O-])c1ccc(N=NNc2ccc(N=Nc3ccccc3)cc2)cc1 ZINC000100027550 563982291 /nfs/dbraw/zinc/98/22/91/563982291.db2.gz SMMIDVLUFMPWFN-VXPUYCOJSA-N 0 0 346.350 6.121 40 10 EKCBRN Nc1ccc(N=Nc2ccc([N+](=O)[N-]c3ccc(N)cc3)cc2)cc1 ZINC000100368350 563982578 /nfs/dbraw/zinc/98/25/78/563982578.db2.gz QVHOCYVXLLNMPB-KATZTRTISA-N 0 0 332.367 5.192 40 10 EKCBRN Nc1ccc(N=Nc2ccc([N+](=O)[N-]c3ccc(N)cc3)cc2)cc1 ZINC000100368352 219097670 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Cc1noc(C)c1C(=O)Nc1ccc(C)cc1/N=N/c1ccc(C)cc1 ZINC000102324313 219194237 /nfs/dbraw/zinc/19/42/37/219194237.db2.gz YJERPWFXSOVECT-GHVJWSGMSA-N 0 0 348.406 5.576 40 10 EKCBRN Cc1ccc(/N=N/c2cc(C)ccc2NC(=O)c2cnc(C)cn2)cc1 ZINC000102324533 219194559 /nfs/dbraw/zinc/19/45/59/219194559.db2.gz UEOZNGPOBBRHAU-OCOZRVBESA-N 0 0 345.406 5.070 40 10 EKCBRN O=C(Nc1ccccc1/N=N/c1ccccc1)c1ccccc1Cl ZINC000102920278 564084922 /nfs/dbraw/zinc/08/49/22/564084922.db2.gz MWTYJMHTUPUDCD-GHVJWSGMSA-N 0 0 335.794 6.008 40 10 EKCBRN CN(C)c1ccc(/N=N/c2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 ZINC000102939754 219242067 /nfs/dbraw/zinc/24/20/67/219242067.db2.gz ZPUWNDGWDXJXEK-FMQUCBEESA-N 0 0 338.289 5.095 40 10 EKCBRN Fc1cccc2c1N[C@@H](c1ccc(Br)cc1)[C@H]1CC=C[C@@H]21 ZINC000103554395 204083690 /nfs/dbraw/zinc/08/36/90/204083690.db2.gz ZJOZRARVXSEVIT-KEYYUXOJSA-N 0 0 344.227 5.415 40 10 EKCBRN CCCC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cc(C)cc(C)c1 ZINC000103918714 564013744 /nfs/dbraw/zinc/01/37/44/564013744.db2.gz 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333.475 6.365 40 10 EKCBRN Cc1ccc(-c2ccc(F)c(Cl)c2)n1-c1ccc(C(C)C)cc1 ZINC000199743735 241041151 /nfs/dbraw/zinc/04/11/51/241041151.db2.gz SCBMGZOWYCMFFR-UHFFFAOYSA-N 0 0 327.830 6.369 40 10 EKCBRN COc1cccc(-n2c(C)ccc2-c2ccc(Br)cc2)c1 ZINC000199744768 537071640 /nfs/dbraw/zinc/07/16/40/537071640.db2.gz LOYIPWQQBSAIOF-UHFFFAOYSA-N 0 0 342.236 5.224 40 10 EKCBRN Cc1ccc(-c2ccc(-c3cccc(Cl)c3)o2)n1-c1ccccc1 ZINC000199746417 241041002 /nfs/dbraw/zinc/04/10/02/241041002.db2.gz NMMYMYDQXDFTOF-UHFFFAOYSA-N 0 0 333.818 6.366 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000205875609 564129732 /nfs/dbraw/zinc/12/97/32/564129732.db2.gz HDJQUGUPWOYXIM-VKJFTORMSA-N 0 0 344.227 5.415 40 10 EKCBRN CCCCOc1ccc(/C=C2/C=C(c3ccc(C)cc3)OC2=O)cc1 ZINC000206277125 564129725 /nfs/dbraw/zinc/12/97/25/564129725.db2.gz BCVUWEZOEIEBDG-RGEXLXHISA-N 0 0 334.415 5.155 40 10 EKCBRN O=C1OC(c2ccc(-c3ccccc3)cc2)=C/C1=C\c1ccccc1O ZINC000211353460 564087367 /nfs/dbraw/zinc/08/73/67/564087367.db2.gz VHSXUCRUAKLJFC-XSFVSMFZSA-N 0 0 340.378 5.041 40 10 EKCBRN Cc1cc(C(=O)C(F)(F)F)c(C)n1-c1ccc(Cl)c(Cl)c1 ZINC000225326629 564045977 /nfs/dbraw/zinc/04/59/77/564045977.db2.gz NSFYKABNKKVEGG-UHFFFAOYSA-N 0 0 336.140 5.146 40 10 EKCBRN Cc1cc(C(=O)C(F)(F)F)c(C)n1-c1ccc(Cl)cc1Cl ZINC000225326700 241825019 /nfs/dbraw/zinc/82/50/19/241825019.db2.gz ZWAJMHNXBMZVCW-UHFFFAOYSA-N 0 0 336.140 5.146 40 10 EKCBRN COc1ccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226648941 257844028 /nfs/dbraw/zinc/84/40/28/257844028.db2.gz SPHWYLXYLGZBMR-GLJUWKHASA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226668714 568421783 /nfs/dbraw/zinc/42/17/83/568421783.db2.gz UNLFBUBYRWEDKD-VKJFTORMSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1ccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226670111 568421786 /nfs/dbraw/zinc/42/17/86/568421786.db2.gz IOCGWRQQDHGLNY-VCBZYWHSSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226672600 568421788 /nfs/dbraw/zinc/42/17/88/568421788.db2.gz HRNBFWCPTFPHIK-GJYPPUQNSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21 ZINC000226676249 257844107 /nfs/dbraw/zinc/84/41/07/257844107.db2.gz SUOMDRVXSVDQSS-VCBZYWHSSA-N 0 0 330.258 6.128 40 10 EKCBRN Clc1ccccc1[C@@H]1Nc2c3ccccc3ccc2[C@@H]2C=CC[C@@H]21 ZINC000226677010 568421787 /nfs/dbraw/zinc/42/17/87/568421787.db2.gz MFRLNQFTNOGHPG-HYFFOGBASA-N 0 0 331.846 6.320 40 10 EKCBRN CC(C)c1ccc([C@@H]2Nc3ccc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226677337 568421784 /nfs/dbraw/zinc/42/17/84/568421784.db2.gz MTRRWPVUHNJTNL-LQWHRVPQSA-N 0 0 334.419 5.545 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@@H](c1cccc3ccccc31)[C@H]1CC=C[C@@H]21 ZINC000226680160 568421785 /nfs/dbraw/zinc/42/17/85/568421785.db2.gz AVYKCLXYUZMRCC-IZIIKQMZSA-N 0 0 325.455 6.283 40 10 EKCBRN CC(C)c1ccc([C@@H]2Nc3c(cccc3[N+](=O)[O-])[C@@H]3C=CC[C@@H]32)cc1 ZINC000226680712 564118291 /nfs/dbraw/zinc/11/82/91/564118291.db2.gz DTJDNEADVADQGH-UWVAXJGDSA-N 0 0 334.419 5.545 40 10 EKCBRN Cc1c(Cl)ccc2c1N[C@H](c1cccc([N+](=O)[O-])c1)[C@@H]1CC=C[C@@H]21 ZINC000226691506 564118289 /nfs/dbraw/zinc/11/82/89/564118289.db2.gz IIZDTBJJAVTGMF-SPYBWZPUSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1c(Cl)ccc2c1N[C@H](c1cccc([N+](=O)[O-])c1)[C@H]1CC=C[C@@H]21 ZINC000226691526 564118299 /nfs/dbraw/zinc/11/82/99/564118299.db2.gz IIZDTBJJAVTGMF-ZRGWGRIASA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000226698356 564118297 /nfs/dbraw/zinc/11/82/97/564118297.db2.gz GYMNOOSLNOCKHR-BIENJYKASA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)c([N+](=O)[O-])c1)N2 ZINC000226698366 257844090 /nfs/dbraw/zinc/84/40/90/257844090.db2.gz GYMNOOSLNOCKHR-PJIJBLCYSA-N 0 0 340.810 5.383 40 10 EKCBRN CC(C)c1ccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226707050 257844110 /nfs/dbraw/zinc/84/41/10/257844110.db2.gz ZGGMOSBLBPCHOK-GPXNEJASSA-N 0 0 339.482 6.790 40 10 EKCBRN Clc1cccc2c1N[C@@H](c1cccc3ccccc31)[C@H]1CC=C[C@@H]21 ZINC000226720243 564118288 /nfs/dbraw/zinc/11/82/88/564118288.db2.gz LGAWKUWFIVZDFQ-MMOPVJDHSA-N 0 0 331.846 6.320 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1cccc3ccccc31)[C@H]1CC=C[C@@H]21 ZINC000226724308 564118305 /nfs/dbraw/zinc/11/83/05/564118305.db2.gz SIFRZNRBFHKHAB-FHJLPGHOSA-N 0 0 345.873 6.628 40 10 EKCBRN Clc1cccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226724895 564118312 /nfs/dbraw/zinc/11/83/12/564118312.db2.gz HETXMVXQMTUNRZ-DYXWJJEUSA-N 0 0 331.846 6.320 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1cccc([N+](=O)[O-])c1)[C@H]1CC=C[C@@H]21 ZINC000226731433 564118309 /nfs/dbraw/zinc/11/83/09/564118309.db2.gz GROFZMVSYYTEAU-VCBZYWHSSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1ccc(C(C)C)cc1)[C@H]1CC=C[C@@H]21 ZINC000226731581 564118287 /nfs/dbraw/zinc/11/82/87/564118287.db2.gz DAAKVIHLYVAONQ-XQBPLPMBSA-N 0 0 348.446 5.853 40 10 EKCBRN Cc1ccc(Cl)c2c1N[C@@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000226732817 257843861 /nfs/dbraw/zinc/84/38/61/257843861.db2.gz KUGHXMAWGLLHJQ-VCBZYWHSSA-N 0 0 330.258 6.128 40 10 EKCBRN Clc1ccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226732994 564118303 /nfs/dbraw/zinc/11/83/03/564118303.db2.gz NORASXVEFYWTDX-DYXWJJEUSA-N 0 0 331.846 6.320 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(F)cccc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000226736286 564118295 /nfs/dbraw/zinc/11/82/95/564118295.db2.gz GJRRXPCSCIKNIM-PEBVRCNWSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(F)cc3[C@@H]3C=CC[C@@H]32)ccc1Cl ZINC000226742649 564118302 /nfs/dbraw/zinc/11/83/02/564118302.db2.gz CXPAZWNIFRNBBB-VBHSOAQHSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cccc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000226744681 564118301 /nfs/dbraw/zinc/11/83/01/564118301.db2.gz UNEOWVZKSSJVKI-QFSBIZTOSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226748027 257844026 /nfs/dbraw/zinc/84/40/26/257844026.db2.gz DRXABWVRGDLOCX-DYXWJJEUSA-N 0 0 342.398 5.575 40 10 EKCBRN COc1ccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226778940 564118296 /nfs/dbraw/zinc/11/82/96/564118296.db2.gz XOVKJSMNGCXOQD-GLJUWKHASA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226779799 564118292 /nfs/dbraw/zinc/11/82/92/564118292.db2.gz BVBBYUSNFKCYLO-VKJFTORMSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226781939 564118290 /nfs/dbraw/zinc/11/82/90/564118290.db2.gz YJBUWBJXZNVNEO-URVUXULASA-N 0 0 327.427 5.675 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226789530 564118314 /nfs/dbraw/zinc/11/83/14/564118314.db2.gz WXEVQSIAUHAZPR-DYXWJJEUSA-N 0 0 342.398 5.575 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000226789818 257843997 /nfs/dbraw/zinc/84/39/97/257843997.db2.gz NCVJEFCEEDKRDR-GLJUWKHASA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226801694 564118285 /nfs/dbraw/zinc/11/82/85/564118285.db2.gz FRSBBEMRGUALDC-GLJUWKHASA-N 0 0 346.257 5.829 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226804834 564118294 /nfs/dbraw/zinc/11/82/94/564118294.db2.gz LOKINRXCCWRUJB-VKJFTORMSA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000226829169 564118304 /nfs/dbraw/zinc/11/83/04/564118304.db2.gz GDKBNKSMMDICMP-CKNLXJGOSA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000226829180 564118308 /nfs/dbraw/zinc/11/83/08/564118308.db2.gz GDKBNKSMMDICMP-JZKQVHKSSA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1ccc2c(c1C)N[C@@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@@H]21 ZINC000226831637 564118300 /nfs/dbraw/zinc/11/83/00/564118300.db2.gz IWIVLVYUCDDUMZ-QEEYODRMSA-N 0 0 344.285 6.437 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2c3ccccc3ccc2[C@@H]2C=CC[C@@H]21 ZINC000226836726 564118311 /nfs/dbraw/zinc/11/83/11/564118311.db2.gz LBMLQITUMYNDTG-HYFFOGBASA-N 0 0 342.398 5.575 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000226838120 564118338 /nfs/dbraw/zinc/11/83/38/564118338.db2.gz UZHGAKDYGWGITB-NQCMUKECSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000226838133 564118315 /nfs/dbraw/zinc/11/83/15/564118315.db2.gz UZHGAKDYGWGITB-VPZZIHKRSA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000226853312 564118335 /nfs/dbraw/zinc/11/83/35/564118335.db2.gz CDXYLJKHFQKHMA-NQCMUKECSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000226853328 257843897 /nfs/dbraw/zinc/84/38/97/257843897.db2.gz CDXYLJKHFQKHMA-VPZZIHKRSA-N 0 0 330.258 6.128 40 10 EKCBRN COc1ccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)cc1OC ZINC000226859228 564118320 /nfs/dbraw/zinc/11/83/20/564118320.db2.gz SZRIAAROGNMWPW-TYILLQQXSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1OC ZINC000226859264 564118333 /nfs/dbraw/zinc/11/83/33/564118333.db2.gz PLYGVCSZODIYCM-SIFCLUCFSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(Cl)ccc(Cl)c2[C@@H]2C=CC[C@@H]21 ZINC000226862194 564118328 /nfs/dbraw/zinc/11/83/28/564118328.db2.gz WTFHVSQCLCMTMD-FTLABTOESA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000226863492 257843430 /nfs/dbraw/zinc/84/34/30/257843430.db2.gz NZSWRHYAWPEYMT-GLJUWKHASA-N 0 0 330.258 6.128 40 10 EKCBRN CCOc1ccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226866663 564118329 /nfs/dbraw/zinc/11/83/29/564118329.db2.gz ZKWVYVWFHOVMEI-GIWBLDEGSA-N 0 0 341.454 6.065 40 10 EKCBRN CCOc1ccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226868029 564118339 /nfs/dbraw/zinc/11/83/39/564118339.db2.gz FEXFDZKJMHMPLX-GJYPPUQNSA-N 0 0 325.839 5.565 40 10 EKCBRN CCOc1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226868038 257843550 /nfs/dbraw/zinc/84/35/50/257843550.db2.gz NHGDZVJXUHSLPD-UWVAXJGDSA-N 0 0 325.839 5.565 40 10 EKCBRN Cc1cccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226872960 564118323 /nfs/dbraw/zinc/11/83/23/564118323.db2.gz DCZGUEJDWGRTIN-VKJFTORMSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cccc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226874085 564118334 /nfs/dbraw/zinc/11/83/34/564118334.db2.gz IFKUEBFKMDNXKY-GJYPPUQNSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1cccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226878845 257844036 /nfs/dbraw/zinc/84/40/36/257844036.db2.gz OJCFGKIZPLHBPP-GLJUWKHASA-N 0 0 330.258 6.128 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226892835 564118344 /nfs/dbraw/zinc/11/83/44/564118344.db2.gz YDGZALBXLXGXFA-KEYYUXOJSA-N 0 0 344.227 5.415 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c3ccccc3ccc2[C@@H]2C=CC[C@@H]21 ZINC000226893398 564118348 /nfs/dbraw/zinc/11/83/48/564118348.db2.gz HUMCEGZJYXGFIV-IEGUWTFLSA-N 0 0 327.427 5.675 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226895264 564118332 /nfs/dbraw/zinc/11/83/32/564118332.db2.gz TVVCHPFRZNFHOU-IGCXYCKISA-N 0 0 334.221 5.959 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@@H](c1c(Cl)cccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000226896449 257843898 /nfs/dbraw/zinc/84/38/98/257843898.db2.gz VYUPYYHGIBFOSV-LAPQFRIASA-N 0 0 344.285 6.437 40 10 EKCBRN COc1cccc([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000226900355 564118321 /nfs/dbraw/zinc/11/83/21/564118321.db2.gz DGYYEJMNWSGRLY-URVUXULASA-N 0 0 327.427 5.675 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2cc(Cl)cc(Cl)c2[C@@H]2C=CC[C@@H]21 ZINC000226900858 257844123 /nfs/dbraw/zinc/84/41/23/257844123.db2.gz UCKDJCCDVSIOLB-QHRIQVFBSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(Cl)c(Cl)ccc2[C@@H]2C=CC[C@@H]21 ZINC000226903082 564118340 /nfs/dbraw/zinc/11/83/40/564118340.db2.gz CDONCQVELSRUAQ-FTLABTOESA-N 0 0 346.257 5.829 40 10 EKCBRN Fc1ccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000226908289 564118330 /nfs/dbraw/zinc/11/83/30/564118330.db2.gz ITBYMZMMTQASQH-GLJUWKHASA-N 0 0 334.221 5.959 40 10 EKCBRN COc1cccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000226910772 564118347 /nfs/dbraw/zinc/11/83/47/564118347.db2.gz FOUXZTFOXLIZCI-VCBZYWHSSA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1ccc(-c2ccc(F)c(Cl)c2)n1-c1ccc(N(C)C)cc1 ZINC000228925961 564118147 /nfs/dbraw/zinc/11/81/47/564118147.db2.gz LSIBRHAMPYXSNB-UHFFFAOYSA-N 0 0 328.818 5.311 40 10 EKCBRN Cc1ccc(-c2ccccc2C(F)(F)F)n1-c1ccc(N(C)C)cc1 ZINC000228928396 564118127 /nfs/dbraw/zinc/11/81/27/564118127.db2.gz DUXDCSQXZNLXEY-UHFFFAOYSA-N 0 0 344.380 5.538 40 10 EKCBRN CCCOc1ccc(-c2ccc(C)n2-c2ccc(N(C)C)cc2)cc1 ZINC000228928868 564118129 /nfs/dbraw/zinc/11/81/29/564118129.db2.gz WEDTWJKUADOBFN-UHFFFAOYSA-N 0 0 334.463 5.308 40 10 EKCBRN COc1cccc(-n2c(C)ccc2-c2cccc(Br)c2)c1 ZINC000228979415 564118202 /nfs/dbraw/zinc/11/82/02/564118202.db2.gz SPVKQUMDAMZGGT-UHFFFAOYSA-N 0 0 342.236 5.224 40 10 EKCBRN O=[N+]([O-])c1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@@H]2C=CC[C@H]21 ZINC000229884945 242211370 /nfs/dbraw/zinc/21/13/70/242211370.db2.gz KBMHBMPVHXODCA-PSTGCABASA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3c(F)cccc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000250101022 564051424 /nfs/dbraw/zinc/05/14/24/564051424.db2.gz GJRRXPCSCIKNIM-QFSBIZTOSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1)N2 ZINC000250105354 564132060 /nfs/dbraw/zinc/13/20/60/564132060.db2.gz CXPHLSMMUZWSTM-VKJFTORMSA-N 0 0 326.783 5.075 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Br)cc1)N2 ZINC000250234514 564132061 /nfs/dbraw/zinc/13/20/61/564132061.db2.gz COIGXZAEQJNRCM-VKJFTORMSA-N 0 0 344.227 5.415 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000250247835 257843387 /nfs/dbraw/zinc/84/33/87/257843387.db2.gz LOKINRXCCWRUJB-RKVPGOIHSA-N 0 0 326.783 5.075 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1c(Cl)cccc1Cl)N2 ZINC000250795035 563922533 /nfs/dbraw/zinc/92/25/33/563922533.db2.gz XCEOLCASSICZGA-FTLABTOESA-N 0 0 334.221 5.959 40 10 EKCBRN Brc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2 ZINC000250807327 564132073 /nfs/dbraw/zinc/13/20/73/564132073.db2.gz IXSLULBINMGVDS-VKJFTORMSA-N 0 0 326.237 5.276 40 10 EKCBRN O=[N+]([O-])c1cc([C@@H]2Nc3ccc(F)cc3[C@@H]3C=CC[C@H]32)ccc1Cl ZINC000250851855 564132069 /nfs/dbraw/zinc/13/20/69/564132069.db2.gz CXPAZWNIFRNBBB-VFVRVIDISA-N 0 0 344.773 5.214 40 10 EKCBRN COC(=O)c1ccc([C@@H]2Nc3c(C(C)C)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000252253003 564132063 /nfs/dbraw/zinc/13/20/63/564132063.db2.gz LUZDOJREFRXSBV-DYXWJJEUSA-N 0 0 347.458 5.423 40 10 EKCBRN COC(=O)c1ccc([C@@H]2Nc3c(C(C)C)cccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000252253004 564132074 /nfs/dbraw/zinc/13/20/74/564132074.db2.gz LUZDOJREFRXSBV-SBHAEUEKSA-N 0 0 347.458 5.423 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3cc(Cl)ccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000253567502 564132225 /nfs/dbraw/zinc/13/22/25/564132225.db2.gz KCWJVGZGANKSEN-LESCRADOSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccc([C@@H]2Nc3cc(Cl)ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000253567503 564132184 /nfs/dbraw/zinc/13/21/84/564132184.db2.gz KCWJVGZGANKSEN-ZVZYQTTQSA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1ccc(Sc2ccc(C=C3SC(=S)NC3=O)cc2)cc1 ZINC000261114355 564132569 /nfs/dbraw/zinc/13/25/69/564132569.db2.gz IODJJMFTTGGLEP-XNTDXEJSSA-N 0 0 343.498 5.046 40 10 EKCBRN CC(c1ccc(Oc2ccc(N)cc2)cc1)(C(F)(F)F)C(F)(F)F ZINC000390823142 568421687 /nfs/dbraw/zinc/42/16/87/568421687.db2.gz UDHLPOYKMCZHMQ-UHFFFAOYSA-N 0 0 349.274 5.443 40 10 EKCBRN Cc1ccc(-c2ccc(C(F)F)cc2)n1-c1ccc(N(C)C)cc1 ZINC000390823160 564173675 /nfs/dbraw/zinc/17/36/75/564173675.db2.gz UWANGMXCGUUFHY-UHFFFAOYSA-N 0 0 326.390 5.456 40 10 EKCBRN CCC1(C)COC(c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)OC1 ZINC000390823252 564118208 /nfs/dbraw/zinc/11/82/08/564118208.db2.gz WYYWMSIPTOQHNQ-UHFFFAOYSA-N 0 0 348.446 5.205 40 10 EKCBRN O=C(Nc1ccccc1)c1ccc2nc3ccc4ccccc4c3nc2c1 ZINC000408721274 257891111 /nfs/dbraw/zinc/89/11/11/257891111.db2.gz GFIYIQDGDGIUGN-UHFFFAOYSA-N 0 0 349.393 5.189 40 10 EKCBRN O=C1OC(c2cccc3ccccc32)=C/C1=C/c1cccc(Cl)c1 ZINC000408721936 257891185 /nfs/dbraw/zinc/89/11/85/257891185.db2.gz BLIRPRWGSZWLCU-WJDWOHSUSA-N 0 0 332.786 5.475 40 10 EKCBRN CCOc1ccc(/C=C2/C=C(c3cccc4ccccc43)OC2=O)cc1 ZINC000408722098 257891263 /nfs/dbraw/zinc/89/12/63/257891263.db2.gz DNVCRMRANVVMSA-JXAWBTAJSA-N 0 0 342.394 5.220 40 10 EKCBRN CCOc1ccc(/C=C2/C=C(c3ccc4ccccc4c3)OC2=O)cc1 ZINC000408722734 563619725 /nfs/dbraw/zinc/61/97/25/563619725.db2.gz MTMSKOSAVSXLSJ-MOSHPQCFSA-N 0 0 342.394 5.220 40 10 EKCBRN O=C1OC(c2ccc3ccccc3c2)=C/C1=C/c1ccccc1Cl ZINC000408722752 563868997 /nfs/dbraw/zinc/86/89/97/563868997.db2.gz MWLJAVUEEKQTPY-PDGQHHTCSA-N 0 0 332.786 5.475 40 10 EKCBRN CC(C)c1ccc(/C=C2/C=C(c3cccc4ccccc43)OC2=O)cc1 ZINC000408722922 563869045 /nfs/dbraw/zinc/86/90/45/563869045.db2.gz OKMXNPLZCNQWRM-ZHZULCJRSA-N 0 0 340.422 5.945 40 10 EKCBRN O=C1OC(c2cccc3ccccc32)=C/C1=C/c1ccc(Cl)cc1 ZINC000408722990 563868985 /nfs/dbraw/zinc/86/89/85/563868985.db2.gz PDEJEAVMBJWFFI-VBKFSLOCSA-N 0 0 332.786 5.475 40 10 EKCBRN O=C1OC(c2ccc3ccccc3c2)=C/C1=C/c1ccc(Cl)cc1 ZINC000408723145 563869295 /nfs/dbraw/zinc/86/92/95/563869295.db2.gz QQIOKLOLTRRADC-WQRHYEAKSA-N 0 0 332.786 5.475 40 10 EKCBRN O=C1OC(c2cccc3ccccc32)=C/C1=C/c1ccccc1Cl ZINC000408723294 563869271 /nfs/dbraw/zinc/86/92/71/563869271.db2.gz STNPMHKBFFFHKM-VBKFSLOCSA-N 0 0 332.786 5.475 40 10 EKCBRN O=C1OC(c2ccc3ccccc3c2)=C/C1=C/c1cccc(Cl)c1 ZINC000408723509 563869331 /nfs/dbraw/zinc/86/93/31/563869331.db2.gz VYKJYLPDWAOKAI-ZDLGFXPLSA-N 0 0 332.786 5.475 40 10 EKCBRN COc1ccc2cc(C3=C/C(=C/c4ccc(C)cc4)C(=O)O3)ccc2c1 ZINC000408723621 563869323 /nfs/dbraw/zinc/86/93/23/563869323.db2.gz YFCMVPDIULHDCS-JAIQZWGSSA-N 0 0 342.394 5.138 40 10 EKCBRN Cc1ccc(/C=C2/C=C(c3ccc4cc(C)ccc4c3)OC2=O)cc1 ZINC000408726385 563869272 /nfs/dbraw/zinc/86/92/72/563869272.db2.gz RDVIKEDGJIHSRW-MTJSOVHGSA-N 0 0 326.395 5.438 40 10 EKCBRN Cc1cc(-c2nc(=O)c3c(C)c(C)sc3[nH]2)c(C)n1-c1ccccc1 ZINC000408735485 563870223 /nfs/dbraw/zinc/87/02/23/563870223.db2.gz SRWMEMBZKWTRNS-UHFFFAOYSA-N 0 0 349.459 5.088 40 10 EKCBRN C1=C[C@H]2c3cc(Oc4ccccc4)ccc3N[C@@H](c3ccccc3)[C@H]2C1 ZINC000408736032 563870354 /nfs/dbraw/zinc/87/03/54/563870354.db2.gz BDWGKDMCWWITBO-DPLHUUCSSA-N 0 0 339.438 6.305 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc3c4c(cccc41)CC3)N2 ZINC000408736072 563870412 /nfs/dbraw/zinc/87/04/12/563870412.db2.gz DAISSBHJHKOJEQ-YIGJPRQDSA-N 0 0 341.429 5.904 40 10 EKCBRN Cc1ccc(C)c([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000408736076 563870402 /nfs/dbraw/zinc/87/04/02/563870402.db2.gz DCNKXYFKYSBHHI-BIENJYKASA-N 0 0 344.285 6.437 40 10 EKCBRN Cc1ccc(C)c([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000408736139 563637689 /nfs/dbraw/zinc/63/76/89/563637689.db2.gz HSUIJPKUMXUQCB-BIENJYKASA-N 0 0 344.285 6.437 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(Cl)ccc(Cl)c2[C@@H]2C=CC[C@@H]21 ZINC000408736145 257889812 /nfs/dbraw/zinc/88/98/12/257889812.db2.gz HZVXQWRTIRAZJJ-VGTOOOLASA-N 0 0 334.221 5.959 40 10 EKCBRN C1=C[C@H]2c3ccc4ccccc4c3N[C@@H](c3ccc4c(c3)OCO4)[C@H]2C1 ZINC000408736217 257890048 /nfs/dbraw/zinc/89/00/48/257890048.db2.gz MBOSOKOXRUGTLU-FGSXEWAUSA-N 0 0 341.410 5.395 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(Cl)c(Cl)ccc2[C@@H]2C=CC[C@@H]21 ZINC000408736246 563870464 /nfs/dbraw/zinc/87/04/64/563870464.db2.gz NQRALESXIDZOBQ-VGTOOOLASA-N 0 0 334.221 5.959 40 10 EKCBRN CC(C)Oc1ccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000408736301 257889954 /nfs/dbraw/zinc/88/99/54/257889954.db2.gz PKKWEMLXJDRZOM-UWVAXJGDSA-N 0 0 339.866 5.954 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000408736315 563870424 /nfs/dbraw/zinc/87/04/24/563870424.db2.gz PMWSAFOKNJMUQG-VBHSOAQHSA-N 0 0 334.221 5.959 40 10 EKCBRN CC(C)Oc1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000408736385 257889772 /nfs/dbraw/zinc/88/97/72/257889772.db2.gz RIUUXOQLMZQBJC-LQWHRVPQSA-N 0 0 339.866 5.954 40 10 EKCBRN CCCOc1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000408736433 563870773 /nfs/dbraw/zinc/87/07/73/563870773.db2.gz SNJZJHHUQWSEPT-LQWHRVPQSA-N 0 0 339.866 5.955 40 10 EKCBRN Cc1ccc(C)c([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000408736442 563870759 /nfs/dbraw/zinc/87/07/59/563870759.db2.gz SYNRTXOLACPGCB-ZRGWGRIASA-N 0 0 344.285 6.437 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Br)c1)N2 ZINC000408736487 257889725 /nfs/dbraw/zinc/88/97/25/257889725.db2.gz WITBSGAPHLJGCY-VKJFTORMSA-N 0 0 344.227 5.415 40 10 EKCBRN C1=C[C@H]2c3ccc4ccccc4c3N[C@@H](c3cccc4ccccc43)[C@H]2C1 ZINC000408736511 257890010 /nfs/dbraw/zinc/89/00/10/257890010.db2.gz WWZAMNDBFWEROI-JJTGBXKASA-N 0 0 347.461 6.820 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(Cl)cc(Cl)cc2[C@@H]2C=CC[C@@H]21 ZINC000408736518 563870732 /nfs/dbraw/zinc/87/07/32/563870732.db2.gz XCOJETWLPZDCAZ-BWACUDIHSA-N 0 0 334.221 5.959 40 10 EKCBRN Cc1ccc(C)c([C@@H]2Nc3c4ccccc4ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000408736648 563638112 /nfs/dbraw/zinc/63/81/12/563638112.db2.gz YRUDINJGOCMCRU-JXALWOEJSA-N 0 0 325.455 6.283 40 10 EKCBRN C1=C[C@H]2c3ccccc3N[C@@H](c3c4ccccc4cc4ccccc43)[C@H]2C1 ZINC000408736914 257890014 /nfs/dbraw/zinc/89/00/14/257890014.db2.gz CTZMNXUSJJVYGD-RZPFDVGOSA-N 0 0 347.461 6.820 40 10 EKCBRN Cc1cccc2c1N[C@@H](c1cc([N+](=O)[O-])ccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000408737100 563870763 /nfs/dbraw/zinc/87/07/63/563870763.db2.gz IRZZZJCTZDECRN-ZUEVXXBESA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc2c(c1C)N[C@@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000408737122 563870755 /nfs/dbraw/zinc/87/07/55/563870755.db2.gz KDXZXNZBWXKPFN-SIFCLUCFSA-N 0 0 344.285 6.437 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21 ZINC000408737361 257889887 /nfs/dbraw/zinc/88/98/87/257889887.db2.gz MNAGXDNOYCTADO-GLJUWKHASA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000408737374 257889643 /nfs/dbraw/zinc/88/96/43/257889643.db2.gz NCJBUHBPVMLTEJ-SIFCLUCFSA-N 0 0 344.285 6.437 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000408737392 257889922 /nfs/dbraw/zinc/88/99/22/257889922.db2.gz OJWZIWHRYCDSCO-TYILLQQXSA-N 0 0 346.257 5.829 40 10 EKCBRN Cc1cccc2c1N[C@@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000408737455 257890063 /nfs/dbraw/zinc/89/00/63/257890063.db2.gz RDHNVEFGMOPVSC-RFUYNDQBSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cccc2c1N[C@@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@@H]21 ZINC000408737669 563870746 /nfs/dbraw/zinc/87/07/46/563870746.db2.gz UIIQEGMGTFYZCU-ZUEVXXBESA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cccc2c1N[C@@H](c1ccc3c4c(cccc41)CC3)[C@H]1CC=C[C@@H]21 ZINC000408737670 563870996 /nfs/dbraw/zinc/87/09/96/563870996.db2.gz UIKAEQJIJVIISD-CTIGNXTNSA-N 0 0 337.466 6.073 40 10 EKCBRN Cc1cccc2c1N[C@@H](c1ccc(Br)cc1)[C@H]1CC=C[C@@H]21 ZINC000408737868 257889958 /nfs/dbraw/zinc/88/99/58/257889958.db2.gz YVAMJWUXNRYNMU-IEZWGBDMSA-N 0 0 340.264 5.584 40 10 EKCBRN Fc1cccc2c1N[C@@H](c1ccc3c4c(cccc41)CC3)[C@H]1CC=C[C@@H]21 ZINC000408737898 563871047 /nfs/dbraw/zinc/87/10/47/563871047.db2.gz ZBFMNZJLJAYXHC-WLENULPWSA-N 0 0 341.429 5.904 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21 ZINC000408737911 563871153 /nfs/dbraw/zinc/87/11/53/563871153.db2.gz ZWIULTHAVQQAHF-KEYYUXOJSA-N 0 0 349.783 6.185 40 10 EKCBRN Cc1ccc(C)n1-c1ccc(OC(=O)c2ccc3ccccc3c2)cc1 ZINC000408738082 563871341 /nfs/dbraw/zinc/87/13/41/563871341.db2.gz IUEDKCCQAOKVHV-UHFFFAOYSA-N 0 0 341.410 5.467 40 10 EKCBRN Cc1ccc(C2=C/C(=C\c3ccc(Cl)c(Cl)c3)C(=O)O2)cc1 ZINC000408741680 563872279 /nfs/dbraw/zinc/87/22/79/563872279.db2.gz KHXZKLJWNGENPQ-RIYZIHGNSA-N 0 0 331.198 5.283 40 10 EKCBRN Cc1ccc(C2=C/C(=C\c3ccc(OCC(C)C)cc3)C(=O)O2)cc1 ZINC000408742292 563872179 /nfs/dbraw/zinc/87/21/79/563872179.db2.gz ODZYPIRQOYUKGE-XDHOZWIPSA-N 0 0 334.415 5.011 40 10 EKCBRN COc1ccc(/C=C2\C=C(c3ccc(C)cc3)OC2=O)c2ccccc12 ZINC000408743297 563872257 /nfs/dbraw/zinc/87/22/57/563872257.db2.gz RYSNEHCTNZZPBZ-QGOAFFKASA-N 0 0 342.394 5.138 40 10 EKCBRN CC(C)Oc1ccc(/C=C2\C=C(c3ccc(Cl)cc3)OC2=O)cc1 ZINC000408744166 563872565 /nfs/dbraw/zinc/87/25/65/563872565.db2.gz XFXSAZXRAGRRQR-LFIBNONCSA-N 0 0 340.806 5.109 40 10 EKCBRN COc1cc(C)c(/C=C2\C=C(c3ccc(C)cc3)OC2=O)cc1C(C)C ZINC000408744761 563872832 /nfs/dbraw/zinc/87/28/32/563872832.db2.gz ZWJQGDOXGUQGHH-YBFXNURJSA-N 0 0 348.442 5.417 40 10 EKCBRN CC(C)(C)c1ccc(C2=C/C(=C\c3c[nH]c4ccccc34)C(=O)O2)cc1 ZINC000408754184 257889553 /nfs/dbraw/zinc/88/95/53/257889553.db2.gz DWBLLUWTSQPXTH-FOWTUZBSSA-N 0 0 343.426 5.447 40 10 EKCBRN CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(C(C)C)c2ccccc12 ZINC000408903827 564007879 /nfs/dbraw/zinc/00/78/79/564007879.db2.gz AABRHAYTJRUFDQ-DEDYPNTBSA-N 0 0 343.430 5.028 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccccc1F ZINC000408964679 564008354 /nfs/dbraw/zinc/00/83/54/564008354.db2.gz FDJFBIWGRVKRAP-UHFFFAOYSA-N 0 0 330.200 5.354 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(Cl)cc1 ZINC000408965142 564008375 /nfs/dbraw/zinc/00/83/75/564008375.db2.gz HAWCKZGGCXDKNV-UHFFFAOYSA-N 0 0 346.655 5.869 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(F)c(C)c1 ZINC000408965522 257884932 /nfs/dbraw/zinc/88/49/32/257884932.db2.gz IEPPXISLSBELSM-UHFFFAOYSA-N 0 0 344.227 5.663 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(C)cc1C ZINC000408965533 563918431 /nfs/dbraw/zinc/91/84/31/563918431.db2.gz IIQPHIQYUYBKRH-UHFFFAOYSA-N 0 0 340.264 5.832 40 10 EKCBRN COc1ccccc1-n1c(C)ccc1-c1ccc(Br)cc1 ZINC000408965553 564008408 /nfs/dbraw/zinc/00/84/08/564008408.db2.gz IRKQWCWGCIDGGY-UHFFFAOYSA-N 0 0 342.236 5.224 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1cc(C)ccc1C ZINC000408965900 563918447 /nfs/dbraw/zinc/91/84/47/563918447.db2.gz JQLRCVASQKOIEC-UHFFFAOYSA-N 0 0 340.264 5.832 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1cccc(C)c1 ZINC000408966004 257884976 /nfs/dbraw/zinc/88/49/76/257884976.db2.gz KVOSXKFDSBSZDB-UHFFFAOYSA-N 0 0 326.237 5.524 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(F)cc1F ZINC000408966008 564008404 /nfs/dbraw/zinc/00/84/04/564008404.db2.gz KWGQHGVCTXPXGC-UHFFFAOYSA-N 0 0 348.190 5.493 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1cccc(F)c1 ZINC000408966375 564008306 /nfs/dbraw/zinc/00/83/06/564008306.db2.gz MHWOLUWMTPXPTA-UHFFFAOYSA-N 0 0 330.200 5.354 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(C)cc1 ZINC000408966553 257884765 /nfs/dbraw/zinc/88/47/65/257884765.db2.gz NDUQLZARPVSDAV-UHFFFAOYSA-N 0 0 326.237 5.524 40 10 EKCBRN COc1ccc(-n2c(C)ccc2-c2ccc(Br)cc2)cc1 ZINC000408966746 257885069 /nfs/dbraw/zinc/88/50/69/257885069.db2.gz NVWHSAKULQRXNX-UHFFFAOYSA-N 0 0 342.236 5.224 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(C)c(C)c1 ZINC000408967747 563918162 /nfs/dbraw/zinc/91/81/62/563918162.db2.gz UKFOKLOLFHBZEN-UHFFFAOYSA-N 0 0 340.264 5.832 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1cccc(Cl)c1 ZINC000408967908 563918286 /nfs/dbraw/zinc/91/82/86/563918286.db2.gz VQPMZBMWLPQRNB-UHFFFAOYSA-N 0 0 346.655 5.869 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccccc1Cl ZINC000408968238 563918209 /nfs/dbraw/zinc/91/82/09/563918209.db2.gz XMNYALMCJCDPDP-UHFFFAOYSA-N 0 0 346.655 5.869 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccccc1C ZINC000408968387 564008426 /nfs/dbraw/zinc/00/84/26/564008426.db2.gz YIWQSCLABPFUFT-UHFFFAOYSA-N 0 0 326.237 5.524 40 10 EKCBRN CCc1ccc(-n2c(C)ccc2-c2ccc(Br)cc2)cc1 ZINC000408968476 517843240 /nfs/dbraw/zinc/84/32/40/517843240.db2.gz ZIAAGJHGCSYVOK-UHFFFAOYSA-N 0 0 340.264 5.778 40 10 EKCBRN CCc1ccccc1-n1c(C)ccc1-c1ccc(Br)cc1 ZINC000408968488 564008435 /nfs/dbraw/zinc/00/84/35/564008435.db2.gz ZNEKPEPWXPSLMM-UHFFFAOYSA-N 0 0 340.264 5.778 40 10 EKCBRN Cc1ccc(-c2ccc(Br)cc2)n1-c1ccc(F)cc1 ZINC000408968499 563918270 /nfs/dbraw/zinc/91/82/70/563918270.db2.gz ZSPYSGQXLKFFII-UHFFFAOYSA-N 0 0 330.200 5.354 40 10 EKCBRN CCN(CC)c1ccc(/C=C2/C=C(c3ccc(C)c(C)c3)OC2=O)cc1 ZINC000408973832 564008471 /nfs/dbraw/zinc/00/84/71/564008471.db2.gz CBNAZOZPDGUBEZ-ZHZULCJRSA-N 0 0 347.458 5.131 40 10 EKCBRN CC(=O)Oc1ccc2nc3c4ccccc4c4ccccc4c3nc2c1 ZINC000408974844 564008461 /nfs/dbraw/zinc/00/84/61/564008461.db2.gz HKRQSVAYSZSQGC-UHFFFAOYSA-N 0 0 338.366 5.015 40 10 EKCBRN CCN(CC)c1ccc(/C=C2/C=C(c3ccc(C)cc3C)OC2=O)cc1 ZINC000408975551 257884272 /nfs/dbraw/zinc/88/42/72/257884272.db2.gz MWSXJCKNWWRKAN-RGEXLXHISA-N 0 0 347.458 5.131 40 10 EKCBRN Cc1ccc([N+](=O)[O-])cc1/C=C1/C=C(c2ccc(C(C)C)cc2)OC1=O ZINC000408976591 564008536 /nfs/dbraw/zinc/00/85/36/564008536.db2.gz RSNWEYYMELFJBA-ZDLGFXPLSA-N 0 0 349.386 5.008 40 10 EKCBRN CCc1ccc(C2=C/C(=C/c3ccc(N(CC)CC)cc3)C(=O)O2)cc1 ZINC000408976841 563922703 /nfs/dbraw/zinc/92/27/03/563922703.db2.gz SNOZSMAQEHCIQH-HKWRFOASSA-N 0 0 347.458 5.077 40 10 EKCBRN O=C(Nc1ccc2nc3ccc4ccccc4c3nc2c1)c1ccccc1 ZINC000408977183 563922693 /nfs/dbraw/zinc/92/26/93/563922693.db2.gz UTEZOYHXCBQUDI-UHFFFAOYSA-N 0 0 349.393 5.189 40 10 EKCBRN CCN(CC)c1ccc(/C=C2/C=C(c3cc(C)ccc3C)OC2=O)cc1 ZINC000408977338 564008567 /nfs/dbraw/zinc/00/85/67/564008567.db2.gz VMFXENKQONLALG-RGEXLXHISA-N 0 0 347.458 5.131 40 10 EKCBRN COc1ccccc1-n1c(-c2ccccc2)cc2c1CC(C)(C)CC2=O ZINC000408977576 563922674 /nfs/dbraw/zinc/92/26/74/563922674.db2.gz WSKMFFIEPBWECD-UHFFFAOYSA-N 0 0 345.442 5.308 40 10 EKCBRN O=C1/C(=C/c2ccccc2)C=C(c2ccc(Cl)cc2)N1c1ccco1 ZINC000408985552 564008679 /nfs/dbraw/zinc/00/86/79/564008679.db2.gz MVWVJGPJJSDRGK-GHRIWEEISA-N 0 0 347.801 5.404 40 10 EKCBRN O=C1OC(c2ccc(-c3ccccc3)cc2)=C/C1=C\c1ccc(O)cc1 ZINC000409051007 563936865 /nfs/dbraw/zinc/93/68/65/563936865.db2.gz GRDFWXUBMOENBG-XSFVSMFZSA-N 0 0 340.378 5.041 40 10 EKCBRN Cc1ccc(/C=C2\C=C(c3ccc(-c4ccccc4)cc3)OC2=O)s1 ZINC000409051907 564009236 /nfs/dbraw/zinc/00/92/36/564009236.db2.gz OTENIUVMKOGDRO-CPNJWEJPSA-N 0 0 344.435 5.705 40 10 EKCBRN O=C1OC(c2ccc(F)cc2)=C/C1=C\c1c(Cl)cccc1Cl ZINC000409052026 564009241 /nfs/dbraw/zinc/00/92/41/564009241.db2.gz PMACKVILJMUEGE-DHZHZOJOSA-N 0 0 335.161 5.114 40 10 EKCBRN Cc1ccc(C2=C/C(=C\c3ccc(Cl)cc3Cl)C(=O)O2)cc1C ZINC000409052283 564009235 /nfs/dbraw/zinc/00/92/35/564009235.db2.gz JCUKIFHEXZBWQS-OVCLIPMQSA-N 0 0 345.225 5.592 40 10 EKCBRN O=C1OC(c2ccc(Oc3ccccc3)cc2)=C/C1=C\c1ccsc1 ZINC000409052495 563937425 /nfs/dbraw/zinc/93/74/25/563937425.db2.gz IAYSIMHCEGHAJV-SFQUDFHCSA-N 0 0 346.407 5.522 40 10 EKCBRN Cc1ccc(/C=C2\C=C(c3ccc(-c4ccccc4)cc3)OC2=O)o1 ZINC000409052606 257881560 /nfs/dbraw/zinc/88/15/60/257881560.db2.gz VCKDWOLOINYTBV-CPNJWEJPSA-N 0 0 328.367 5.236 40 10 EKCBRN CCCCOc1ccc(/C=C2\C=C(c3cc(C)ccc3C)OC2=O)cc1 ZINC000409052635 564009149 /nfs/dbraw/zinc/00/91/49/564009149.db2.gz VFFOBCAJHCRHJD-XMHGGMMESA-N 0 0 348.442 5.464 40 10 EKCBRN CCCCOc1ccc(/C=C2\C=C(c3ccc(C)cc3C)OC2=O)cc1 ZINC000409052905 257881461 /nfs/dbraw/zinc/88/14/61/257881461.db2.gz BKJLMHWALGWULZ-XMHGGMMESA-N 0 0 348.442 5.464 40 10 EKCBRN Cc1ccsc1/C=C1\C=C(c2ccc(-c3ccccc3)cc2)OC1=O ZINC000409053043 564009191 /nfs/dbraw/zinc/00/91/91/564009191.db2.gz JMKMNPVYWQLRPO-XMHGGMMESA-N 0 0 344.435 5.705 40 10 EKCBRN Cc1ccc(C)c(C2=C/C(=C\c3cccc4ccccc34)C(=O)O2)c1 ZINC000409053189 563937440 /nfs/dbraw/zinc/93/74/40/563937440.db2.gz MMCSJNHWRBEBNL-CPNJWEJPSA-N 0 0 326.395 5.438 40 10 EKCBRN O=C1OC(c2ccc(-c3ccccc3)cc2)=C/C1=C\c1ccsc1 ZINC000409053766 257881411 /nfs/dbraw/zinc/88/14/11/257881411.db2.gz PFYPQZHYURUDAF-XDHOZWIPSA-N 0 0 330.408 5.396 40 10 EKCBRN Cc1ccc(/C=C2\C=C(c3ccc(Oc4ccccc4)cc3)OC2=O)o1 ZINC000409054064 563937458 /nfs/dbraw/zinc/93/74/58/563937458.db2.gz QTDJAPSOOQUEKC-GHRIWEEISA-N 0 0 344.366 5.362 40 10 EKCBRN Cc1ccc(C2=C/C(=C\c3c(O)ccc4ccccc43)C(=O)O2)c(C)c1 ZINC000409054113 563937408 /nfs/dbraw/zinc/93/74/08/563937408.db2.gz RLDKXXPLGUGVJI-SFQUDFHCSA-N 0 0 342.394 5.144 40 10 EKCBRN O=C1OC(c2ccc(F)cc2)=C/C1=C\c1ccc(Cl)cc1Cl ZINC000409054903 564009310 /nfs/dbraw/zinc/00/93/10/564009310.db2.gz WFWDYDJWDUIBRB-KPKJPENVSA-N 0 0 335.161 5.114 40 10 EKCBRN Cc1ccc(C2=C/C(=C\c3cccc4ccccc34)C(=O)O2)c(C)c1 ZINC000409055497 563937428 /nfs/dbraw/zinc/93/74/28/563937428.db2.gz IYGIVMXANOAYSO-CPNJWEJPSA-N 0 0 326.395 5.438 40 10 EKCBRN Cc1ccc(C)c(C2=C/C(=C\c3c(O)ccc4ccccc43)C(=O)O2)c1 ZINC000409055527 564009283 /nfs/dbraw/zinc/00/92/83/564009283.db2.gz ZDTIWSNUUYELGL-SFQUDFHCSA-N 0 0 342.394 5.144 40 10 EKCBRN Cc1ccc(/C=C2\C=C(c3ccc(-c4ccccc4)cc3)OC2=O)cc1 ZINC000409058121 563937092 /nfs/dbraw/zinc/93/70/92/563937092.db2.gz RKVUFULKPAHEAL-PXLXIMEGSA-N 0 0 338.406 5.643 40 10 EKCBRN CCCCOc1ccc(/C=C2\C=C(c3ccc(C)c(C)c3)OC2=O)cc1 ZINC000409060421 564009309 /nfs/dbraw/zinc/00/93/09/564009309.db2.gz ZVCUELCOMHDKSD-XSFVSMFZSA-N 0 0 348.442 5.464 40 10 EKCBRN Cc1cc(/C=C2\Sc3ccccc3NC2=O)c(C)n1-c1ccccc1 ZINC000409097512 564009869 /nfs/dbraw/zinc/00/98/69/564009869.db2.gz IUIIQXVWWFEROG-MOSHPQCFSA-N 0 0 346.455 5.179 40 10 EKCBRN CCN(CC)c1ccc(/C=C2/c3ccccc3N(CC(C)C)C2=O)cc1 ZINC000409109233 564009973 /nfs/dbraw/zinc/00/99/73/564009973.db2.gz AAAXPEVNGMBACU-QNGOZBTKSA-N 0 0 348.490 5.076 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2cc(Cl)cc(Cl)c2[C@@H]2C=CC[C@@H]21 ZINC000409150781 564010521 /nfs/dbraw/zinc/01/05/21/564010521.db2.gz DRRBOMYDEVHTAG-FTLABTOESA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2cc(Cl)cc(Cl)c2[C@H]2C=CC[C@@H]21 ZINC000409150783 257877191 /nfs/dbraw/zinc/87/71/91/257877191.db2.gz DRRBOMYDEVHTAG-OAVHHTNSSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2cc(Cl)cc(Cl)c2[C@@H]2C=CC[C@H]21 ZINC000409150785 563963919 /nfs/dbraw/zinc/96/39/19/563963919.db2.gz DRRBOMYDEVHTAG-SEDUGSJDSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2cc(Cl)cc(Cl)c2[C@H]2C=CC[C@H]21 ZINC000409150787 563963939 /nfs/dbraw/zinc/96/39/39/563963939.db2.gz DRRBOMYDEVHTAG-VNBZBWLYSA-N 0 0 334.221 5.959 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(C)cc(Cl)cc2[C@@H]2C=CC[C@@H]21 ZINC000409150995 563963917 /nfs/dbraw/zinc/96/39/17/563963917.db2.gz FUEYWMBOSHYQAF-QEEYODRMSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(C)cc(Cl)cc2[C@@H]2C=CC[C@H]21 ZINC000409150996 564010536 /nfs/dbraw/zinc/01/05/36/564010536.db2.gz FUEYWMBOSHYQAF-STXHMFSFSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000409151075 564010533 /nfs/dbraw/zinc/01/05/33/564010533.db2.gz AAIIZNBFPYTRHH-FHSNZYRGSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000409151078 564010526 /nfs/dbraw/zinc/01/05/26/564010526.db2.gz AAIIZNBFPYTRHH-SNUQEOBHSA-N 0 0 346.257 5.829 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000409151092 257877172 /nfs/dbraw/zinc/87/71/72/257877172.db2.gz ABXYIXFQCGWGNI-CKNLXJGOSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1Cl)N2 ZINC000409151095 257877103 /nfs/dbraw/zinc/87/71/03/257877103.db2.gz ABXYIXFQCGWGNI-JZKQVHKSSA-N 0 0 344.285 6.382 40 10 EKCBRN Fc1cc(F)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc3ccccc31)N2 ZINC000409151199 563963945 /nfs/dbraw/zinc/96/39/45/563963945.db2.gz ANLCUVJSQBNHLY-BLIXFSHQSA-N 0 0 333.381 5.945 40 10 EKCBRN Fc1cc(F)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc3ccccc31)N2 ZINC000409151204 257877254 /nfs/dbraw/zinc/87/72/54/257877254.db2.gz ANLCUVJSQBNHLY-HGHGUNKESA-N 0 0 333.381 5.945 40 10 EKCBRN Fc1cc(F)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc3ccccc31)N2 ZINC000409151209 563963916 /nfs/dbraw/zinc/96/39/16/563963916.db2.gz ANLCUVJSQBNHLY-MMOPVJDHSA-N 0 0 333.381 5.945 40 10 EKCBRN Fc1cc(F)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc3ccccc31)N2 ZINC000409151211 563963918 /nfs/dbraw/zinc/96/39/18/563963918.db2.gz ANLCUVJSQBNHLY-PLMTUMEDSA-N 0 0 333.381 5.945 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1cccc(F)c1)[C@@H]1CC=C[C@@H]21 ZINC000409151427 564010538 /nfs/dbraw/zinc/01/05/38/564010538.db2.gz GUBWJSHDWVKGDJ-HBUWYVDXSA-N 0 0 329.802 5.314 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1cccc(F)c1)[C@H]1CC=C[C@@H]21 ZINC000409151433 257877130 /nfs/dbraw/zinc/87/71/30/257877130.db2.gz GUBWJSHDWVKGDJ-QWQRMKEZSA-N 0 0 329.802 5.314 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409151557 564010515 /nfs/dbraw/zinc/01/05/15/564010515.db2.gz CFOKWBYRLKCLIJ-LPMFXHHGSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000409151561 257877174 /nfs/dbraw/zinc/87/71/74/257877174.db2.gz CFOKWBYRLKCLIJ-TYILLQQXSA-N 0 0 330.258 6.128 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@H]3C=CC[C@H]32)c1 ZINC000409151888 563963922 /nfs/dbraw/zinc/96/39/22/563963922.db2.gz CONBKWJIBOYFGK-AHIWAGSCSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@H]3C=CC[C@@H]32)c1 ZINC000409151891 564010578 /nfs/dbraw/zinc/01/05/78/564010578.db2.gz CONBKWJIBOYFGK-DCGLDWPTSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000409151895 564010601 /nfs/dbraw/zinc/01/06/01/564010601.db2.gz CONBKWJIBOYFGK-IGCXYCKISA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@H]32)c1 ZINC000409151898 257877194 /nfs/dbraw/zinc/87/71/94/257877194.db2.gz CONBKWJIBOYFGK-XNJGSVPQSA-N 0 0 334.221 5.959 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000409152185 563963973 /nfs/dbraw/zinc/96/39/73/563963973.db2.gz JIWGXEVLAVSATH-IIDMSEBBSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(Cl)cc1)N2 ZINC000409152192 257877124 /nfs/dbraw/zinc/87/71/24/257877124.db2.gz JIWGXEVLAVSATH-RKVPGOIHSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1)N2 ZINC000409152196 563963977 /nfs/dbraw/zinc/96/39/77/563963977.db2.gz JIWGXEVLAVSATH-RVKKMQEKSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(Cl)cc1)N2 ZINC000409152200 563963952 /nfs/dbraw/zinc/96/39/52/563963952.db2.gz JIWGXEVLAVSATH-VKJFTORMSA-N 0 0 349.783 6.185 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@H]3C=CC[C@@H]32)cc1 ZINC000409152523 563963956 /nfs/dbraw/zinc/96/39/56/563963956.db2.gz FQKTVOPZWNGMLL-DEYYWGMASA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@H]3C=CC[C@H]32)cc1 ZINC000409152525 563963972 /nfs/dbraw/zinc/96/39/72/563963972.db2.gz FQKTVOPZWNGMLL-IYOUNJFTSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)ccc([N+](=O)[O-])c3[C@@H]3C=CC[C@H]32)cc1 ZINC000409152528 563963964 /nfs/dbraw/zinc/96/39/64/563963964.db2.gz FQKTVOPZWNGMLL-LBTNJELSSA-N 0 0 340.810 5.383 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@@H]21 ZINC000409152538 564010583 /nfs/dbraw/zinc/01/05/83/564010583.db2.gz BKUKMNFOAQWQKU-NBQZKYEYSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@@H]21 ZINC000409152545 564010587 /nfs/dbraw/zinc/01/05/87/564010587.db2.gz BKUKMNFOAQWQKU-UVFQYZLESA-N 0 0 343.392 6.094 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@H]3C=CC[C@H]32)cc1 ZINC000409152577 564010577 /nfs/dbraw/zinc/01/05/77/564010577.db2.gz JOWOWNWIHNARPN-DAYGRLMNSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@H]3C=CC[C@@H]32)cc1 ZINC000409152578 257877133 /nfs/dbraw/zinc/87/71/33/257877133.db2.gz JOWOWNWIHNARPN-MPGHIAIKSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409152579 564010592 /nfs/dbraw/zinc/01/05/92/564010592.db2.gz JOWOWNWIHNARPN-RKVPGOIHSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(Cl)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409152580 563963957 /nfs/dbraw/zinc/96/39/57/563963957.db2.gz JOWOWNWIHNARPN-VKJFTORMSA-N 0 0 340.810 5.383 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@@H]2C=CC[C@@H]21 ZINC000409152595 257876656 /nfs/dbraw/zinc/87/66/56/257876656.db2.gz KJERCJOYANCGAH-BWACUDIHSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@@H]21 ZINC000409152596 563963965 /nfs/dbraw/zinc/96/39/65/563963965.db2.gz KJERCJOYANCGAH-NVGCLXPQSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@@H]2C=CC[C@H]21 ZINC000409152597 257876799 /nfs/dbraw/zinc/87/67/99/257876799.db2.gz KJERCJOYANCGAH-PSTGCABASA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2c(Cl)cccc2[C@H]2C=CC[C@H]21 ZINC000409152598 563963960 /nfs/dbraw/zinc/96/39/60/563963960.db2.gz KJERCJOYANCGAH-XWCIJXRUSA-N 0 0 349.783 6.185 40 10 EKCBRN Cc1ccc(C)c2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@H]21 ZINC000409152615 257876893 /nfs/dbraw/zinc/87/68/93/257876893.db2.gz KNMFIPDIGZBKAN-AVYPCKFXSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1ccc(C)c2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@H]21 ZINC000409152616 564010596 /nfs/dbraw/zinc/01/05/96/564010596.db2.gz KNMFIPDIGZBKAN-MDOVXXIYSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1ccc(C)c2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@@H]21 ZINC000409152617 563963970 /nfs/dbraw/zinc/96/39/70/563963970.db2.gz KNMFIPDIGZBKAN-SIFCLUCFSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1ccc(C)c2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@@H]21 ZINC000409152618 563963967 /nfs/dbraw/zinc/96/39/67/563963967.db2.gz KNMFIPDIGZBKAN-SXGZJXTBSA-N 0 0 343.392 6.149 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@H]21 ZINC000409152891 564010585 /nfs/dbraw/zinc/01/05/85/564010585.db2.gz LMZSJDHKDQWGEO-KSMMKXTCSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409152897 563963963 /nfs/dbraw/zinc/96/39/63/563963963.db2.gz LMZSJDHKDQWGEO-LPMFXHHGSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@H]21 ZINC000409152901 257876864 /nfs/dbraw/zinc/87/68/64/257876864.db2.gz LMZSJDHKDQWGEO-NJSLBKSFSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000409152906 257876849 /nfs/dbraw/zinc/87/68/49/257876849.db2.gz LMZSJDHKDQWGEO-TYILLQQXSA-N 0 0 325.839 5.484 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2 ZINC000409153416 257876756 /nfs/dbraw/zinc/87/67/56/257876756.db2.gz HYPRJHPVTSLJHW-CKEIUWERSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1)N2 ZINC000409153420 563964042 /nfs/dbraw/zinc/96/40/42/563964042.db2.gz HYPRJHPVTSLJHW-CPUCHLNUSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1)N2 ZINC000409153423 563964019 /nfs/dbraw/zinc/96/40/19/563964019.db2.gz HYPRJHPVTSLJHW-JKIFEVAISA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2 ZINC000409153426 564010594 /nfs/dbraw/zinc/01/05/94/564010594.db2.gz HYPRJHPVTSLJHW-KEYYUXOJSA-N 0 0 326.783 5.075 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2 ZINC000409153873 564010599 /nfs/dbraw/zinc/01/05/99/564010599.db2.gz ITHRBPDEIDRBSG-GPMSIDNRSA-N 0 0 338.382 5.177 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409153925 563964031 /nfs/dbraw/zinc/96/40/31/563964031.db2.gz MZLAPNHWIUXPHX-GIWBLDEGSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@H]32)c1 ZINC000409153930 563964032 /nfs/dbraw/zinc/96/40/32/563964032.db2.gz MZLAPNHWIUXPHX-XPNTWCBSSA-N 0 0 341.429 6.319 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c([N+](=O)[O-])cc(C)c(C)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409154047 564010602 /nfs/dbraw/zinc/01/06/02/564010602.db2.gz FQOOELCVCYXFEV-LQWHRVPQSA-N 0 0 348.446 5.601 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c([N+](=O)[O-])cc(C)c(C)c3[C@@H]3C=CC[C@H]32)cc1 ZINC000409154051 564010593 /nfs/dbraw/zinc/01/05/93/564010593.db2.gz FQOOELCVCYXFEV-OPYAIIAOSA-N 0 0 348.446 5.601 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@H]32)cc1 ZINC000409154671 257876888 /nfs/dbraw/zinc/87/68/88/257876888.db2.gz KRAHTRWGCRSXBT-CLCXKQKWSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)ccc(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409154676 563964066 /nfs/dbraw/zinc/96/40/66/563964066.db2.gz KRAHTRWGCRSXBT-VCBZYWHSSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409154820 257876958 /nfs/dbraw/zinc/87/69/58/257876958.db2.gz KWNDRZWYSBJIJA-GJYPPUQNSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409154824 257876642 /nfs/dbraw/zinc/87/66/42/257876642.db2.gz KWNDRZWYSBJIJA-MDZRGWNJSA-N 0 0 344.285 6.382 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)c1OC ZINC000409154867 564010632 /nfs/dbraw/zinc/01/06/32/564010632.db2.gz KTLFVBOSIPJKMS-FHSNZYRGSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@H]32)c1OC ZINC000409154871 563964069 /nfs/dbraw/zinc/96/40/69/563964069.db2.gz KTLFVBOSIPJKMS-SNUQEOBHSA-N 0 0 341.838 5.184 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@@H]2C=CC[C@@H]21 ZINC000409154914 563964074 /nfs/dbraw/zinc/96/40/74/563964074.db2.gz OWNVRYSLEXSWJQ-BIENJYKASA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@@H]2C=CC[C@H]21 ZINC000409154922 563964068 /nfs/dbraw/zinc/96/40/68/563964068.db2.gz OWNVRYSLEXSWJQ-PJIJBLCYSA-N 0 0 345.364 5.541 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000409155445 564010617 /nfs/dbraw/zinc/01/06/17/564010617.db2.gz PXNGAYRBTNVDIF-FHSNZYRGSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1C(F)(F)F)N2 ZINC000409155453 257876663 /nfs/dbraw/zinc/87/66/63/257876663.db2.gz PXNGAYRBTNVDIF-SNUQEOBHSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409155457 257876853 /nfs/dbraw/zinc/87/68/53/257876853.db2.gz PXNGAYRBTNVDIF-VBHSOAQHSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409155460 563964015 /nfs/dbraw/zinc/96/40/15/563964015.db2.gz PXNGAYRBTNVDIF-VFVRVIDISA-N 0 0 333.328 5.671 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409156065 257876955 /nfs/dbraw/zinc/87/69/55/257876955.db2.gz SXYMNJNQNIZTGX-LPMFXHHGSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409156640 257876655 /nfs/dbraw/zinc/87/66/55/257876655.db2.gz SXYMNJNQNIZTGX-TYILLQQXSA-N 0 0 329.365 5.840 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409156712 257876953 /nfs/dbraw/zinc/87/69/53/257876953.db2.gz GUWAUZSWBMUJSI-CLCXKQKWSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409156716 563964080 /nfs/dbraw/zinc/96/40/80/563964080.db2.gz GUWAUZSWBMUJSI-VCBZYWHSSA-N 0 0 344.285 6.382 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CC=C[C@@H]21 ZINC000409156754 257876640 /nfs/dbraw/zinc/87/66/40/257876640.db2.gz TTWBDPRUKCQTGC-GPMSIDNRSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21 ZINC000409156763 257876647 /nfs/dbraw/zinc/87/66/47/257876647.db2.gz TTWBDPRUKCQTGC-JTDSTZFVSA-N 0 0 330.258 6.128 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@@H]2C=CC[C@@H]21 ZINC000409156858 564010611 /nfs/dbraw/zinc/01/06/11/564010611.db2.gz UVIJTESVECERER-FHSNZYRGSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@@H]2C=CC[C@H]21 ZINC000409156863 564010608 /nfs/dbraw/zinc/01/06/08/564010608.db2.gz UVIJTESVECERER-SNUQEOBHSA-N 0 0 345.364 5.541 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(-c3ccccc3)cccc2[C@@H]2C=CC[C@H]21 ZINC000409156890 564010635 /nfs/dbraw/zinc/01/06/35/564010635.db2.gz UDASVPTYZHGHNG-MFSJNOQSSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(-c3ccccc3)cccc2[C@@H]2C=CC[C@@H]21 ZINC000409156898 257876855 /nfs/dbraw/zinc/87/68/55/257876855.db2.gz UDASVPTYZHGHNG-VAXXYWNWSA-N 0 0 341.429 6.319 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2 ZINC000409157701 257876658 /nfs/dbraw/zinc/87/66/58/257876658.db2.gz WIQDDCQTFLPECL-PBFPGSCMSA-N 0 0 326.783 5.075 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccccc1)N2 ZINC000409157707 564010662 /nfs/dbraw/zinc/01/06/62/564010662.db2.gz WIQDDCQTFLPECL-XNJGSVPQSA-N 0 0 326.783 5.075 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)c1OC ZINC000409157808 563964229 /nfs/dbraw/zinc/96/42/29/563964229.db2.gz NONUBNFJDDEJJJ-BIENJYKASA-N 0 0 341.838 5.184 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@H]32)c1OC ZINC000409157815 563964217 /nfs/dbraw/zinc/96/42/17/563964217.db2.gz NONUBNFJDDEJJJ-PJIJBLCYSA-N 0 0 341.838 5.184 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1F)N2 ZINC000409157931 563964317 /nfs/dbraw/zinc/96/43/17/563964317.db2.gz WFPGZINONMCWQD-AGKHESDQSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccccc1F)N2 ZINC000409157934 564010562 /nfs/dbraw/zinc/01/05/62/564010562.db2.gz WFPGZINONMCWQD-CZIZLABSSA-N 0 0 344.773 5.214 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000409158198 564010559 /nfs/dbraw/zinc/01/05/59/564010559.db2.gz XUWXYHSBSSCURJ-SIFCLUCFSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)cc1Cl)N2 ZINC000409158205 563965822 /nfs/dbraw/zinc/96/58/22/563965822.db2.gz XUWXYHSBSSCURJ-SXGZJXTBSA-N 0 0 344.285 6.382 40 10 EKCBRN CC(C)c1ccc([C@@H]2Nc3c(F)cc(F)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409158276 563965882 /nfs/dbraw/zinc/96/58/82/563965882.db2.gz YADFRNYTNOBBCR-HLIPFELVSA-N 0 0 325.402 5.915 40 10 EKCBRN CC(C)c1ccc([C@@H]2Nc3c(F)cc(F)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409158285 564010575 /nfs/dbraw/zinc/01/05/75/564010575.db2.gz YADFRNYTNOBBCR-UWVAXJGDSA-N 0 0 325.402 5.915 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2 ZINC000409158422 564010553 /nfs/dbraw/zinc/01/05/53/564010553.db2.gz XKIKCQSQCLZTBD-CKEIUWERSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1)N2 ZINC000409158428 564010566 /nfs/dbraw/zinc/01/05/66/564010566.db2.gz XKIKCQSQCLZTBD-CPUCHLNUSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(F)cc1)N2 ZINC000409158435 257876959 /nfs/dbraw/zinc/87/69/59/257876959.db2.gz XKIKCQSQCLZTBD-JKIFEVAISA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccc(F)cc1)N2 ZINC000409158441 563966379 /nfs/dbraw/zinc/96/63/79/563966379.db2.gz XKIKCQSQCLZTBD-KEYYUXOJSA-N 0 0 344.773 5.214 40 10 EKCBRN Fc1cccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@H]3C=CC[C@@H]32)c1 ZINC000409158582 563966355 /nfs/dbraw/zinc/96/63/55/563966355.db2.gz XRSOVDKRHLOLFY-DEYYWGMASA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@@H]3C=CC[C@@H]32)c1 ZINC000409158587 564010554 /nfs/dbraw/zinc/01/05/54/564010554.db2.gz XRSOVDKRHLOLFY-GLJUWKHASA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@H]3C=CC[C@H]32)c1 ZINC000409158590 563966350 /nfs/dbraw/zinc/96/63/50/563966350.db2.gz XRSOVDKRHLOLFY-IYOUNJFTSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@@H]3C=CC[C@H]32)c1 ZINC000409158593 563966367 /nfs/dbraw/zinc/96/63/67/563966367.db2.gz XRSOVDKRHLOLFY-LBTNJELSSA-N 0 0 334.221 5.959 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Br)c1)[C@@H]1CC=C[C@@H]21 ZINC000409158630 563966353 /nfs/dbraw/zinc/96/63/53/563966353.db2.gz RQLIEBFPAKXTTQ-KVSKMBFKSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Br)c1)[C@H]1CC=C[C@@H]21 ZINC000409158636 563966376 /nfs/dbraw/zinc/96/63/76/563966376.db2.gz RQLIEBFPAKXTTQ-VDZJLULYSA-N 0 0 340.264 5.584 40 10 EKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1)N2 ZINC000409158677 563966306 /nfs/dbraw/zinc/96/63/06/563966306.db2.gz SBDDBJSDBXAFFZ-IGCXYCKISA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1)N2 ZINC000409158678 563966370 /nfs/dbraw/zinc/96/63/70/563966370.db2.gz SBDDBJSDBXAFFZ-IIYDPXPESA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1)N2 ZINC000409158679 563966349 /nfs/dbraw/zinc/96/63/49/563966349.db2.gz SBDDBJSDBXAFFZ-PBFPGSCMSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccccc1)N2 ZINC000409158680 257876848 /nfs/dbraw/zinc/87/68/48/257876848.db2.gz SBDDBJSDBXAFFZ-XNJGSVPQSA-N 0 0 349.783 6.185 40 10 EKCBRN CCc1ccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409158945 257876920 /nfs/dbraw/zinc/87/69/20/257876920.db2.gz ULIJJUQFYSLWEE-GUXCAODWSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc([C@@H]2Nc3cc(Cl)cc(Cl)c3[C@@H]3C=CC[C@H]32)cc1 ZINC000409158952 564010567 /nfs/dbraw/zinc/01/05/67/564010567.db2.gz ULIJJUQFYSLWEE-QINHECLXSA-N 0 0 344.285 6.382 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CC=C[C@@H]21 ZINC000409159045 564010568 /nfs/dbraw/zinc/01/05/68/564010568.db2.gz MJSOHUMANNVPFL-ZBQZNYHESA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CC=C[C@@H]21 ZINC000409159050 563966372 /nfs/dbraw/zinc/96/63/72/563966372.db2.gz MJSOHUMANNVPFL-ZUEVXXBESA-N 0 0 340.810 5.383 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409159368 257876868 /nfs/dbraw/zinc/87/68/68/257876868.db2.gz TWAUNHZYGPIFAB-CPUCHLNUSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409159371 563966442 /nfs/dbraw/zinc/96/64/42/563966442.db2.gz TWAUNHZYGPIFAB-KEYYUXOJSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@H]32)c1 ZINC000409159375 563966472 /nfs/dbraw/zinc/96/64/72/563966472.db2.gz TWAUNHZYGPIFAB-VBQJREDUSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)cc(Cl)cc3[C@H]3C=CC[C@@H]32)c1 ZINC000409159378 563966466 /nfs/dbraw/zinc/96/64/66/563966466.db2.gz TWAUNHZYGPIFAB-ZQIUZPCESA-N 0 0 334.221 5.959 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000409159459 563966467 /nfs/dbraw/zinc/96/64/67/563966467.db2.gz ZYOSNOKLQQTJQL-DKICVRJWSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)c(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000409159460 564010565 /nfs/dbraw/zinc/01/05/65/564010565.db2.gz ZYOSNOKLQQTJQL-YYFZDKIDSA-N 0 0 344.285 6.382 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409159609 257876911 /nfs/dbraw/zinc/87/69/11/257876911.db2.gz OCVGPVLFGQBNSX-FMTVUPSXSA-N 0 0 346.257 5.829 40 10 EKCBRN COc1ccc(Cl)c2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000409159611 563966457 /nfs/dbraw/zinc/96/64/57/563966457.db2.gz OCVGPVLFGQBNSX-SOZUMNATSA-N 0 0 346.257 5.829 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409159646 257876866 /nfs/dbraw/zinc/87/68/66/257876866.db2.gz RQAVFWBJOKADEC-NBQZKYEYSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1ccc(Cl)cc1Cl)[C@H]1CC=C[C@@H]21 ZINC000409159649 563966461 /nfs/dbraw/zinc/96/64/61/563966461.db2.gz RQAVFWBJOKADEC-UVFQYZLESA-N 0 0 344.285 6.382 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@H]32)c1 ZINC000409159816 563966487 /nfs/dbraw/zinc/96/64/87/563966487.db2.gz VDAPGRSFKLRFKI-AHIWAGSCSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@H]3C=CC[C@@H]32)c1 ZINC000409159818 563966477 /nfs/dbraw/zinc/96/64/77/563966477.db2.gz VDAPGRSFKLRFKI-DCGLDWPTSA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409159820 563966475 /nfs/dbraw/zinc/96/64/75/563966475.db2.gz VDAPGRSFKLRFKI-IGCXYCKISA-N 0 0 334.221 5.959 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Cl)c(Cl)ccc3[C@@H]3C=CC[C@H]32)c1 ZINC000409159822 257876665 /nfs/dbraw/zinc/87/66/65/257876665.db2.gz VDAPGRSFKLRFKI-XNJGSVPQSA-N 0 0 334.221 5.959 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(F)c1)N2 ZINC000409160152 564010555 /nfs/dbraw/zinc/01/05/55/564010555.db2.gz PTPKBGAIRBMCOK-GPMSIDNRSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(F)c1)N2 ZINC000409160153 563966494 /nfs/dbraw/zinc/96/64/94/563966494.db2.gz PTPKBGAIRBMCOK-JTDSTZFVSA-N 0 0 338.382 5.177 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@@H]21 ZINC000409160624 257876754 /nfs/dbraw/zinc/87/67/54/257876754.db2.gz VALWTPIONXDUMR-VBHSOAQHSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@@H]21 ZINC000409160625 564010548 /nfs/dbraw/zinc/01/05/48/564010548.db2.gz VALWTPIONXDUMR-VFVRVIDISA-N 0 0 345.364 5.541 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000409160969 563966482 /nfs/dbraw/zinc/96/64/82/563966482.db2.gz RUYVZZCYGDKTSJ-CKEIUWERSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000409160970 564010586 /nfs/dbraw/zinc/01/05/86/564010586.db2.gz RUYVZZCYGDKTSJ-JKIFEVAISA-N 0 0 349.783 6.185 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@@H]2C=CC[C@@H]21 ZINC000409161485 564010641 /nfs/dbraw/zinc/01/06/41/564010641.db2.gz XVRQRZUYVRCPIU-BWACUDIHSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(cccc2C(F)(F)F)[C@@H]2C=CC[C@H]21 ZINC000409161486 564010651 /nfs/dbraw/zinc/01/06/51/564010651.db2.gz XVRQRZUYVRCPIU-PSTGCABASA-N 0 0 333.328 5.671 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1ccc(F)cc1)N2 ZINC000409161594 563966484 /nfs/dbraw/zinc/96/64/84/563966484.db2.gz WEZLBKIVUDIZDD-PBFPGSCMSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1ccc(F)cc1)N2 ZINC000409161595 257876927 /nfs/dbraw/zinc/87/69/27/257876927.db2.gz WEZLBKIVUDIZDD-XNJGSVPQSA-N 0 0 344.773 5.214 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409161701 257876874 /nfs/dbraw/zinc/87/68/74/257876874.db2.gz YSMZVRGYUNOZES-HLIPFELVSA-N 0 0 337.894 6.464 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(Cl)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409161706 564010657 /nfs/dbraw/zinc/01/06/57/564010657.db2.gz YSMZVRGYUNOZES-UWVAXJGDSA-N 0 0 337.894 6.464 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409161815 257876913 /nfs/dbraw/zinc/87/69/13/257876913.db2.gz BACGYYGUFCUIRE-GJYPPUQNSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409161819 564010658 /nfs/dbraw/zinc/01/06/58/564010658.db2.gz BACGYYGUFCUIRE-MDZRGWNJSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1ccc2c(c1C)N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@@H]21 ZINC000409162073 257876751 /nfs/dbraw/zinc/87/67/51/257876751.db2.gz CLAMKTUZNRAEJA-SIFCLUCFSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1ccc2c(c1C)N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@@H]21 ZINC000409162075 563966517 /nfs/dbraw/zinc/96/65/17/563966517.db2.gz CLAMKTUZNRAEJA-SXGZJXTBSA-N 0 0 343.392 6.149 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409162108 257876793 /nfs/dbraw/zinc/87/67/93/257876793.db2.gz CTJQJNQDWWSJDB-GIWBLDEGSA-N 0 0 341.429 6.319 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(-c4ccccc4)cccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409162110 563966541 /nfs/dbraw/zinc/96/65/41/563966541.db2.gz CTJQJNQDWWSJDB-XPNTWCBSSA-N 0 0 341.429 6.319 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@@H]21 ZINC000409162217 563966529 /nfs/dbraw/zinc/96/65/29/563966529.db2.gz YNWKTZSODGXJPZ-SIFCLUCFSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1cc(C)c2c(c1)N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@@H]21 ZINC000409162218 257876922 /nfs/dbraw/zinc/87/69/22/257876922.db2.gz YNWKTZSODGXJPZ-SXGZJXTBSA-N 0 0 343.392 6.149 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@H]32)c1 ZINC000409162561 563966575 /nfs/dbraw/zinc/96/65/75/563966575.db2.gz FYAHHTVADVIBRK-CPUCHLNUSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(Br)cccc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409162563 563966551 /nfs/dbraw/zinc/96/65/51/563966551.db2.gz FYAHHTVADVIBRK-KEYYUXOJSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(Br)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409162709 563966550 /nfs/dbraw/zinc/96/65/50/563966550.db2.gz HDJQUGUPWOYXIM-RKVPGOIHSA-N 0 0 344.227 5.415 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CC=C[C@H]21 ZINC000409162771 563966562 /nfs/dbraw/zinc/96/65/62/563966562.db2.gz HOFHYZAOUOUXBO-FRQCXROJSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccc(Cl)cc1)[C@@H]1CC=C[C@@H]21 ZINC000409162772 564010672 /nfs/dbraw/zinc/01/06/72/564010672.db2.gz HOFHYZAOUOUXBO-GPMSIDNRSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@@H]21 ZINC000409162773 563966574 /nfs/dbraw/zinc/96/65/74/563966574.db2.gz HOFHYZAOUOUXBO-JTDSTZFVSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1ccc(Cl)cc1)[C@H]1CC=C[C@H]21 ZINC000409162774 563966559 /nfs/dbraw/zinc/96/65/59/563966559.db2.gz HOFHYZAOUOUXBO-TXPKVOOTSA-N 0 0 325.839 5.484 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(F)cc(F)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409162871 564010684 /nfs/dbraw/zinc/01/06/84/564010684.db2.gz IWNUEZBTQIZNSA-HLIPFELVSA-N 0 0 339.429 6.089 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(F)cc(F)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409162872 564010688 /nfs/dbraw/zinc/01/06/88/564010688.db2.gz IWNUEZBTQIZNSA-UWVAXJGDSA-N 0 0 339.429 6.089 40 10 EKCBRN Cc1ccc([C@@H]2Nc3ccc(-c4ccccc4)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409163150 564010695 /nfs/dbraw/zinc/01/06/95/564010695.db2.gz MMLBRMONMFCDPB-RQTOMXEWSA-N 0 0 337.466 6.489 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc([N+](=O)[O-])cc1)[C@@H]1CC=C[C@@H]21 ZINC000409163387 563966581 /nfs/dbraw/zinc/96/65/81/563966581.db2.gz QVSLMHWONDMOKI-GPMSIDNRSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc([N+](=O)[O-])cc1)[C@H]1CC=C[C@@H]21 ZINC000409163388 563966580 /nfs/dbraw/zinc/96/65/80/563966580.db2.gz QVSLMHWONDMOKI-JTDSTZFVSA-N 0 0 340.810 5.383 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@H]32)cc1 ZINC000409163394 257876649 /nfs/dbraw/zinc/87/66/49/257876649.db2.gz QXJRKJHNTLAZRD-CPUCHLNUSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@@H]32)cc1 ZINC000409163395 563966545 /nfs/dbraw/zinc/96/65/45/563966545.db2.gz QXJRKJHNTLAZRD-KEYYUXOJSA-N 0 0 333.328 5.671 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3ccc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409163686 564010681 /nfs/dbraw/zinc/01/06/81/564010681.db2.gz WIIBDLVLCILWFT-LQWHRVPQSA-N 0 0 348.446 5.719 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3ccc([N+](=O)[O-])cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409163687 564010686 /nfs/dbraw/zinc/01/06/86/564010686.db2.gz WIIBDLVLCILWFT-OPYAIIAOSA-N 0 0 348.446 5.719 40 10 EKCBRN CCc1ccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409163923 563966613 /nfs/dbraw/zinc/96/66/13/563966613.db2.gz ZRAOADWHLOUMSP-HLIPFELVSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1ccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409163924 257876177 /nfs/dbraw/zinc/87/61/77/257876177.db2.gz ZRAOADWHLOUMSP-UWVAXJGDSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409164022 257876179 /nfs/dbraw/zinc/87/61/79/257876179.db2.gz BGRULYLJWHWHBB-AGKSTNPPSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@@H]21 ZINC000409164023 563966653 /nfs/dbraw/zinc/96/66/53/563966653.db2.gz BGRULYLJWHWHBB-KPHUOKFYSA-N 0 0 344.285 6.382 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1Cl)N2 ZINC000409164099 564010693 /nfs/dbraw/zinc/01/06/93/564010693.db2.gz CKARVLBUFHPZIG-FHSNZYRGSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1Cl)N2 ZINC000409164100 563966637 /nfs/dbraw/zinc/96/66/37/563966637.db2.gz CKARVLBUFHPZIG-SNUQEOBHSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1Cl)N2 ZINC000409164101 563966641 /nfs/dbraw/zinc/96/66/41/563966641.db2.gz CKARVLBUFHPZIG-VBHSOAQHSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1Cl)N2 ZINC000409164102 257876361 /nfs/dbraw/zinc/87/63/61/257876361.db2.gz CKARVLBUFHPZIG-VFVRVIDISA-N 0 0 349.783 6.185 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@@H]2C=CC[C@@H]21 ZINC000409164215 564010675 /nfs/dbraw/zinc/01/06/75/564010675.db2.gz FBIMYVXCMDIONZ-FHSNZYRGSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2ccc(C(F)(F)F)cc2[C@@H]2C=CC[C@H]21 ZINC000409164216 257876492 /nfs/dbraw/zinc/87/64/92/257876492.db2.gz FBIMYVXCMDIONZ-SNUQEOBHSA-N 0 0 333.328 5.671 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc(C(C)C)cc1)[C@@H]1CC=C[C@@H]21 ZINC000409164876 564010694 /nfs/dbraw/zinc/01/06/94/564010694.db2.gz PADBRLDYNQFHRI-WOIUINJBSA-N 0 0 337.894 6.598 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccc(C(C)C)cc1)[C@H]1CC=C[C@@H]21 ZINC000409164877 564010674 /nfs/dbraw/zinc/01/06/74/564010674.db2.gz PADBRLDYNQFHRI-XQBPLPMBSA-N 0 0 337.894 6.598 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc3ccccc31)[C@@H]1CC=C[C@@H]21 ZINC000409165133 257876412 /nfs/dbraw/zinc/87/64/12/257876412.db2.gz SZBBPTVFVLCXGA-KKLQWCBXSA-N 0 0 345.873 6.628 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc3ccccc31)[C@H]1CC=C[C@@H]21 ZINC000409165134 563966969 /nfs/dbraw/zinc/96/69/69/563966969.db2.gz SZBBPTVFVLCXGA-QMHWCDLVSA-N 0 0 345.873 6.628 40 10 EKCBRN Cc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@@H]32)cc1 ZINC000409165158 257876404 /nfs/dbraw/zinc/87/64/04/257876404.db2.gz UACQIXPDFBOADR-VKJFTORMSA-N 0 0 329.365 5.840 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@H]32)c1 ZINC000409165397 257876488 /nfs/dbraw/zinc/87/64/88/257876488.db2.gz XTSMZNZYPVJSOT-CPUCHLNUSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@@H]32)c1 ZINC000409165398 564010702 /nfs/dbraw/zinc/01/07/02/564010702.db2.gz XTSMZNZYPVJSOT-KEYYUXOJSA-N 0 0 333.328 5.671 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@H]32)c1 ZINC000409165565 257876187 /nfs/dbraw/zinc/87/61/87/257876187.db2.gz ZOLHHARSBGUCGN-RKVPGOIHSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@@H]32)c1 ZINC000409165566 564010722 /nfs/dbraw/zinc/01/07/22/564010722.db2.gz ZOLHHARSBGUCGN-VKJFTORMSA-N 0 0 345.364 5.541 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@@H]32)cc1 ZINC000409166258 563967096 /nfs/dbraw/zinc/96/70/96/563967096.db2.gz DAAWXZHTYYZPFN-GJYPPUQNSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(cccc3C(F)(F)F)[C@@H]3C=CC[C@H]32)cc1 ZINC000409166365 257876291 /nfs/dbraw/zinc/87/62/91/257876291.db2.gz DAAWXZHTYYZPFN-MDZRGWNJSA-N 0 0 343.392 6.094 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(C)cc(Cl)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409166637 564010726 /nfs/dbraw/zinc/01/07/26/564010726.db2.gz FOFCCIQLSTUKHL-HLIPFELVSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1cccc([C@@H]2Nc3c(C)cc(Cl)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409166639 564010718 /nfs/dbraw/zinc/01/07/18/564010718.db2.gz FOFCCIQLSTUKHL-UWVAXJGDSA-N 0 0 325.839 5.484 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1Br)[C@@H]1CC=C[C@@H]21 ZINC000409166733 564010716 /nfs/dbraw/zinc/01/07/16/564010716.db2.gz FMOSKNHXZVNOLL-OHNRDTAOSA-N 0 0 340.264 5.584 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1Br)[C@H]1CC=C[C@@H]21 ZINC000409166735 563967149 /nfs/dbraw/zinc/96/71/49/563967149.db2.gz FMOSKNHXZVNOLL-RFUYNDQBSA-N 0 0 340.264 5.584 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1cccc(Cl)c1)N2 ZINC000409166818 564010699 /nfs/dbraw/zinc/01/06/99/564010699.db2.gz GHNPBGOGXGMWNP-IIDMSEBBSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1cccc(Cl)c1)N2 ZINC000409166822 564010723 /nfs/dbraw/zinc/01/07/23/564010723.db2.gz GHNPBGOGXGMWNP-RKVPGOIHSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(Cl)c1)N2 ZINC000409166827 563967152 /nfs/dbraw/zinc/96/71/52/563967152.db2.gz GHNPBGOGXGMWNP-RVKKMQEKSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1cccc(Cl)c1)N2 ZINC000409166831 564010701 /nfs/dbraw/zinc/01/07/01/564010701.db2.gz GHNPBGOGXGMWNP-VKJFTORMSA-N 0 0 349.783 6.185 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000409167342 564010697 /nfs/dbraw/zinc/01/06/97/564010697.db2.gz IGYGTCPQRYWSBI-GPMSIDNRSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000409167345 564010712 /nfs/dbraw/zinc/01/07/12/564010712.db2.gz IGYGTCPQRYWSBI-JTDSTZFVSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@@H]1CC=C[C@@H]21 ZINC000409167389 564010711 /nfs/dbraw/zinc/01/07/11/564010711.db2.gz IIFXGXUGZVTJEC-OHNRDTAOSA-N 0 0 329.365 5.840 40 10 EKCBRN Cc1cccc2c1N[C@H](c1ccccc1C(F)(F)F)[C@H]1CC=C[C@@H]21 ZINC000409167511 564010720 /nfs/dbraw/zinc/01/07/20/564010720.db2.gz IIFXGXUGZVTJEC-RFUYNDQBSA-N 0 0 329.365 5.840 40 10 EKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@@H]21 ZINC000409167558 257876502 /nfs/dbraw/zinc/87/65/02/257876502.db2.gz IQWJWWZBPUIEQD-CKEIUWERSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@H]21 ZINC000409167561 563967150 /nfs/dbraw/zinc/96/71/50/563967150.db2.gz IQWJWWZBPUIEQD-GRDNDAEWSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1)[C@@H]1CC=C[C@H]21 ZINC000409167564 563967141 /nfs/dbraw/zinc/96/71/41/563967141.db2.gz IQWJWWZBPUIEQD-JJRVBVJISA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cc(Br)cc2c1N[C@H](c1ccccc1)[C@H]1CC=C[C@@H]21 ZINC000409167567 563967173 /nfs/dbraw/zinc/96/71/73/563967173.db2.gz IQWJWWZBPUIEQD-JKIFEVAISA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409167592 257876348 /nfs/dbraw/zinc/87/63/48/257876348.db2.gz IWBGPKNYDIIHGU-RKVPGOIHSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409167595 257876346 /nfs/dbraw/zinc/87/63/46/257876346.db2.gz IWBGPKNYDIIHGU-VKJFTORMSA-N 0 0 333.328 5.671 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@@H]2C=CC[C@@H]21 ZINC000409168151 564010714 /nfs/dbraw/zinc/01/07/14/564010714.db2.gz KSTBWQDYGITTJK-BWACUDIHSA-N 0 0 344.227 5.415 40 10 EKCBRN Fc1ccccc1[C@@H]1Nc2c(Br)cccc2[C@@H]2C=CC[C@H]21 ZINC000409168152 257876193 /nfs/dbraw/zinc/87/61/93/257876193.db2.gz KSTBWQDYGITTJK-PSTGCABASA-N 0 0 344.227 5.415 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1ccccc1Cl)[C@H]1CC=C[C@@H]21 ZINC000409168550 564010740 /nfs/dbraw/zinc/01/07/40/564010740.db2.gz MKZPMYGXIWTRDV-PEBVRCNWSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1cccc2c1N[C@H](c1ccccc1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409168551 563967161 /nfs/dbraw/zinc/96/71/61/563967161.db2.gz MKZPMYGXIWTRDV-QFSBIZTOSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@@H]2C=CC[C@@H]21 ZINC000409168599 564010738 /nfs/dbraw/zinc/01/07/38/564010738.db2.gz MSSFGSHQZFXNQE-FHSNZYRGSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@@H]2C=CC[C@H]21 ZINC000409168600 257876448 /nfs/dbraw/zinc/87/64/48/257876448.db2.gz MSSFGSHQZFXNQE-SNUQEOBHSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@H]2C=CC[C@H]21 ZINC000409168601 564010735 /nfs/dbraw/zinc/01/07/35/564010735.db2.gz MSSFGSHQZFXNQE-VEVIJQCQSA-N 0 0 349.783 6.185 40 10 EKCBRN FC(F)(F)c1ccccc1[C@@H]1Nc2ccc(Cl)cc2[C@H]2C=CC[C@@H]21 ZINC000409168602 257876350 /nfs/dbraw/zinc/87/63/50/257876350.db2.gz MSSFGSHQZFXNQE-ZJNRKIDTSA-N 0 0 349.783 6.185 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](c1ccccc1F)N2 ZINC000409168820 563967164 /nfs/dbraw/zinc/96/71/64/563967164.db2.gz NVPQHMFPMZWZGE-BWACUDIHSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1F)N2 ZINC000409168822 563967151 /nfs/dbraw/zinc/96/71/51/563967151.db2.gz NVPQHMFPMZWZGE-PEBVRCNWSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](c1ccccc1F)N2 ZINC000409168824 563967162 /nfs/dbraw/zinc/96/71/62/563967162.db2.gz NVPQHMFPMZWZGE-PSTGCABASA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1cc(Cl)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1F)N2 ZINC000409168826 564010728 /nfs/dbraw/zinc/01/07/28/564010728.db2.gz NVPQHMFPMZWZGE-QFSBIZTOSA-N 0 0 344.773 5.214 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@@H]32)c1 ZINC000409168969 564010731 /nfs/dbraw/zinc/01/07/31/564010731.db2.gz OIVDMALOADVGGF-GJYPPUQNSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1cccc([C@@H]2Nc3ccc(C(F)(F)F)cc3[C@@H]3C=CC[C@H]32)c1 ZINC000409168971 257876411 /nfs/dbraw/zinc/87/64/11/257876411.db2.gz OIVDMALOADVGGF-MDZRGWNJSA-N 0 0 345.364 5.541 40 10 EKCBRN Cc1cc([N+](=O)[O-])c2c(c1C)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1F)N2 ZINC000409169129 564010742 /nfs/dbraw/zinc/01/07/42/564010742.db2.gz OXUZNLHCHBBKQR-LPMFXHHGSA-N 0 0 338.382 5.177 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccccc1[N+](=O)[O-])[C@@H]1CC=C[C@@H]21 ZINC000409170887 563967370 /nfs/dbraw/zinc/96/73/70/563967370.db2.gz XSCPUKDKUIHBLI-LPMFXHHGSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1ccccc1[N+](=O)[O-])[C@H]1CC=C[C@@H]21 ZINC000409170889 563967359 /nfs/dbraw/zinc/96/73/59/563967359.db2.gz XSCPUKDKUIHBLI-TYILLQQXSA-N 0 0 340.810 5.383 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@H]21 ZINC000409170976 563967335 /nfs/dbraw/zinc/96/73/35/563967335.db2.gz XQMNOMGPDUMSIW-FRQCXROJSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1cccc(Cl)c1)[C@@H]1CC=C[C@@H]21 ZINC000409170977 564010784 /nfs/dbraw/zinc/01/07/84/564010784.db2.gz XQMNOMGPDUMSIW-GPMSIDNRSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@@H]21 ZINC000409170978 257876447 /nfs/dbraw/zinc/87/64/47/257876447.db2.gz XQMNOMGPDUMSIW-JTDSTZFVSA-N 0 0 325.839 5.484 40 10 EKCBRN COc1ccc(C)c2c1N[C@H](c1cccc(Cl)c1)[C@H]1CC=C[C@H]21 ZINC000409170979 257876498 /nfs/dbraw/zinc/87/64/98/257876498.db2.gz XQMNOMGPDUMSIW-TXPKVOOTSA-N 0 0 325.839 5.484 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(C)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409171137 257876398 /nfs/dbraw/zinc/87/63/98/257876398.db2.gz YGERKLPLLHBMDC-LQWHRVPQSA-N 0 0 334.419 5.292 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(C)cc([N+](=O)[O-])cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409171142 563967364 /nfs/dbraw/zinc/96/73/64/563967364.db2.gz YGERKLPLLHBMDC-OPYAIIAOSA-N 0 0 334.419 5.292 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@@H]1CC=C[C@@H]21 ZINC000409171156 563967388 /nfs/dbraw/zinc/96/73/88/563967388.db2.gz YHWZSPFORQQEOH-CFZJUORYSA-N 0 0 330.258 6.128 40 10 EKCBRN Cc1cccc2c1N[C@H](c1cccc(Cl)c1Cl)[C@H]1CC=C[C@@H]21 ZINC000409171158 564010751 /nfs/dbraw/zinc/01/07/51/564010751.db2.gz YHWZSPFORQQEOH-PJFSTRORSA-N 0 0 330.258 6.128 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@H](c1cccc(F)c1)N2 ZINC000409171207 257876433 /nfs/dbraw/zinc/87/64/33/257876433.db2.gz ZJHAXPIFBUMFEH-IGCXYCKISA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@@H]1[C@@H](c1cccc(F)c1)N2 ZINC000409171209 563967379 /nfs/dbraw/zinc/96/73/79/563967379.db2.gz ZJHAXPIFBUMFEH-IIYDPXPESA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@@H](c1cccc(F)c1)N2 ZINC000409171211 257876514 /nfs/dbraw/zinc/87/65/14/257876514.db2.gz ZJHAXPIFBUMFEH-PBFPGSCMSA-N 0 0 344.773 5.214 40 10 EKCBRN O=[N+]([O-])c1ccc(Cl)c2c1[C@@H]1C=CC[C@H]1[C@H](c1cccc(F)c1)N2 ZINC000409171212 257876428 /nfs/dbraw/zinc/87/64/28/257876428.db2.gz ZJHAXPIFBUMFEH-XNJGSVPQSA-N 0 0 344.773 5.214 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409171513 563967450 /nfs/dbraw/zinc/96/74/50/563967450.db2.gz CRWHCJBYGMSYQE-LQWHRVPQSA-N 0 0 337.894 6.464 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3ccc(Cl)cc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409171514 563967471 /nfs/dbraw/zinc/96/74/71/563967471.db2.gz CRWHCJBYGMSYQE-OPYAIIAOSA-N 0 0 337.894 6.464 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc([N+](=O)[O-])c1)[C@@H]1CC=C[C@@H]21 ZINC000409171702 257876396 /nfs/dbraw/zinc/87/63/96/257876396.db2.gz FLKFTUMRESLJJL-GPMSIDNRSA-N 0 0 340.810 5.383 40 10 EKCBRN Cc1cc(Cl)cc2c1N[C@H](c1cccc([N+](=O)[O-])c1)[C@H]1CC=C[C@@H]21 ZINC000409171703 563967394 /nfs/dbraw/zinc/96/73/94/563967394.db2.gz FLKFTUMRESLJJL-JTDSTZFVSA-N 0 0 340.810 5.383 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409172575 564010729 /nfs/dbraw/zinc/01/07/29/564010729.db2.gz DADDUHAYNSSTBF-QEEYODRMSA-N 0 0 344.285 6.382 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccc(Cl)c(Cl)c1)N2 ZINC000409172576 564010754 /nfs/dbraw/zinc/01/07/54/564010754.db2.gz DADDUHAYNSSTBF-STXHMFSFSA-N 0 0 344.285 6.382 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409172863 563967555 /nfs/dbraw/zinc/96/75/55/563967555.db2.gz GEVLJELTOZVTGW-SIFCLUCFSA-N 0 0 343.392 6.149 40 10 EKCBRN Cc1cc(C)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409172866 257876276 /nfs/dbraw/zinc/87/62/76/257876276.db2.gz GEVLJELTOZVTGW-SXGZJXTBSA-N 0 0 343.392 6.149 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409173516 563967670 /nfs/dbraw/zinc/96/76/70/563967670.db2.gz JFAGLZABTTXQKF-LPMFXHHGSA-N 0 0 345.364 5.541 40 10 EKCBRN COc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409173517 563967672 /nfs/dbraw/zinc/96/76/72/563967672.db2.gz JFAGLZABTTXQKF-TYILLQQXSA-N 0 0 345.364 5.541 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(cccc3[N+](=O)[O-])[C@@H]3C=CC[C@H]32)cc1 ZINC000409173520 563967671 /nfs/dbraw/zinc/96/76/71/563967671.db2.gz JGCGIDODUGVBGX-HLIPFELVSA-N 0 0 348.446 5.719 40 10 EKCBRN CC(C)(C)c1ccc([C@@H]2Nc3c(cccc3[N+](=O)[O-])[C@@H]3C=CC[C@@H]32)cc1 ZINC000409173521 563967681 /nfs/dbraw/zinc/96/76/81/563967681.db2.gz JGCGIDODUGVBGX-UWVAXJGDSA-N 0 0 348.446 5.719 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409174082 257876424 /nfs/dbraw/zinc/87/64/24/257876424.db2.gz LDVSISJNFFENMD-SIFCLUCFSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1ccc2c(c1)[C@@H]1C=CC[C@H]1[C@@H](c1ccccc1C(F)(F)F)N2 ZINC000409174083 564010753 /nfs/dbraw/zinc/01/07/53/564010753.db2.gz LDVSISJNFFENMD-SXGZJXTBSA-N 0 0 343.392 6.094 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(C)c(C(=O)OC)ccc3[C@@H]3C=CC[C@@H]32)cc1 ZINC000409175378 563968145 /nfs/dbraw/zinc/96/81/45/563968145.db2.gz RCBPDMMUWLMOCC-DXIQSLLYSA-N 0 0 347.458 5.171 40 10 EKCBRN CCc1ccc([C@@H]2Nc3c(C)c(C(=O)OC)ccc3[C@@H]3C=CC[C@H]32)cc1 ZINC000409175381 563968126 /nfs/dbraw/zinc/96/81/26/563968126.db2.gz RCBPDMMUWLMOCC-KNKQGSTJSA-N 0 0 347.458 5.171 40 10 EKCBRN CCN1C(=O)/C(=C/c2cn(CC(C)C)c3ccccc23)c2ccccc21 ZINC000409193966 563970874 /nfs/dbraw/zinc/97/08/74/563970874.db2.gz JCTGRUFFGIXMOO-DEDYPNTBSA-N 0 0 344.458 5.204 40 10 EKCBRN Cc1ccc(C(=O)C(=O)c2ccccc2-c2ccccc2)c(Cl)c1 ZINC000409196762 563970888 /nfs/dbraw/zinc/97/08/88/563970888.db2.gz XMSBJOJTJSYUNL-UHFFFAOYSA-N 0 0 334.802 5.381 40 10 EKCBRN Cc1cc(C(=S)N2CCCCC2)c(C)n1-c1ccc(C)c(Cl)c1 ZINC000409196778 563970873 /nfs/dbraw/zinc/97/08/73/563970873.db2.gz XRKBPOLCDNFGBR-UHFFFAOYSA-N 0 0 346.927 5.217 40 10 EKCBRN CCN1C(=O)/C(=C/c2cc(C)n(C3CCCC3)c2C)c2ccccc21 ZINC000409202126 563970989 /nfs/dbraw/zinc/97/09/89/563970989.db2.gz ZXWGPJXRAACVSK-XSFVSMFZSA-N 0 0 334.463 5.127 40 10 EKCBRN Cc1ccc(C(=O)C(=O)C(c2ccccc2)c2ccccc2)c(Cl)c1 ZINC000409204807 564011083 /nfs/dbraw/zinc/01/10/83/564011083.db2.gz KUFXDMKNOBVTNC-UHFFFAOYSA-N 0 0 348.829 5.232 40 10 EKCBRN CCN1C(=O)/C(=C/c2cc(C)n(-c3ccccc3)c2C)c2ccccc21 ZINC000409206296 564010993 /nfs/dbraw/zinc/01/09/93/564010993.db2.gz TWEIRXKJVNIRGV-RCCKNPSSSA-N 0 0 342.442 5.001 40 10 EKCBRN