smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)CCn1cccc1CN1CCC(CC(N)=O)CC1 ZINC000159846732 519704019 /nfs/dbraw/zinc/70/40/19/519704019.db2.gz OREAAMLYCFITPT-UHFFFAOYSA-N 0 3 291.439 2.622 20 70 CFIDHN CCOC[C@H]1CCCN(Cc2cnc3ccccn23)C1 ZINC000160410979 520170917 /nfs/dbraw/zinc/17/09/17/520170917.db2.gz ACWFKFZXCKRKFC-AWEZNQCLSA-N 0 3 273.380 2.583 20 70 CFIDHN CCO[C@@H]1C[C@H](NCc2cc(OC)ccc2OC)C1(C)C ZINC000217893836 520427755 /nfs/dbraw/zinc/42/77/55/520427755.db2.gz NTRVHCLJYIFGES-JKSUJKDBSA-N 0 3 293.407 2.997 20 70 CFIDHN CCN(Cc1cccc(F)c1)C(=O)[C@H](C(C)C)N(C)C ZINC000159542201 521349389 /nfs/dbraw/zinc/34/93/89/521349389.db2.gz XSRWTTQDPFJULS-HNNXBMFYSA-N 0 3 280.387 2.760 20 70 CFIDHN CCOc1ccccc1[C@H](C)N[C@H](CCO)CSC ZINC000160366974 521586413 /nfs/dbraw/zinc/58/64/13/521586413.db2.gz FFVQXURSKBJFTF-QWHCGFSZSA-N 0 3 283.437 2.850 20 70 CFIDHN COC(=O)c1ccc(CN2CC[C@@H](C(C)(C)C)C2)nc1 ZINC000160583625 522015175 /nfs/dbraw/zinc/01/51/75/522015175.db2.gz VFWSQLHFSXQFTJ-CYBMUJFWSA-N 0 3 276.380 2.736 20 70 CFIDHN CC[C@@H](C)c1cc(C(=O)N[C@@H](C)CN2CCCCC2)on1 ZINC000160369454 522421114 /nfs/dbraw/zinc/42/11/14/522421114.db2.gz GHLZMJUQDYYTEH-OLZOCXBDSA-N 0 3 293.411 2.792 20 70 CFIDHN COc1ccccc1CCNCc1c(C)noc1C ZINC000218596617 524422430 /nfs/dbraw/zinc/42/24/30/524422430.db2.gz WZXWIDWRNASIPD-UHFFFAOYSA-N 0 3 260.337 2.632 20 70 CFIDHN Cc1cc(CN2CC[C@H](O)[C@H](C)C2)c2ccccc2n1 ZINC000159397898 524705599 /nfs/dbraw/zinc/70/55/99/524705599.db2.gz FRVRENSSHHKMOF-PXAZEXFGSA-N 0 3 270.376 2.746 20 70 CFIDHN Cc1ccccc1[C@@H](C)NCC(=O)N(C)CC(F)(F)F ZINC000159679053 525360127 /nfs/dbraw/zinc/36/01/27/525360127.db2.gz STDZZSFGXSGXHG-LLVKDONJSA-N 0 3 288.313 2.666 20 70 CFIDHN C[C@H](NC[C@@H]1CC(=O)Nc2ccccc21)c1cncc(F)c1 ZINC000160682044 525384355 /nfs/dbraw/zinc/38/43/55/525384355.db2.gz HNAPIQNQNGUGHD-AAEUAGOBSA-N 0 3 299.349 2.997 20 70 CFIDHN CSCC[C@@H](N)C(=O)NCCCCC1CCCC1 ZINC000160901336 525541451 /nfs/dbraw/zinc/54/14/51/525541451.db2.gz KZRBUUXBCYZYNQ-CYBMUJFWSA-N 0 3 272.458 2.544 20 70 CFIDHN CSC[C@H](CCO)N[C@@H](C)c1ccc(F)cc1 ZINC000160355631 525700101 /nfs/dbraw/zinc/70/01/01/525700101.db2.gz ZWYXWWXPYOJYKD-GWCFXTLKSA-N 0 3 257.374 2.590 20 70 CFIDHN Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@H](C)CC(N)=O ZINC000161363634 526660687 /nfs/dbraw/zinc/66/06/87/526660687.db2.gz WHXBZOLHGYQJBW-BDAKNGLRSA-N 0 3 283.441 2.664 20 70 CFIDHN CCOCCCN(Cc1ccco1)C[C@H]1CCCO1 ZINC000159587255 528660039 /nfs/dbraw/zinc/66/00/39/528660039.db2.gz NDVCZSWBHYEXDH-OAHLLOKOSA-N 0 3 267.369 2.687 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccccc1C)CC2 ZINC000159597061 282118493 /nfs/dbraw/zinc/11/84/93/282118493.db2.gz HZTHAJRQXJHSNO-OCCSQVGLSA-N 0 3 270.380 2.561 20 70 CFIDHN C[C@H]1CN(C(=O)N[C@H]2CCN(CC3CC3)C2)c2ccccc21 ZINC000160760364 348020472 /nfs/dbraw/zinc/02/04/72/348020472.db2.gz CFKWJASMCWHDKU-ZFWWWQNUSA-N 0 3 299.418 2.804 20 70 CFIDHN CCC(C)(CC)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21 ZINC000159494763 539825821 /nfs/dbraw/zinc/82/58/21/539825821.db2.gz XQJIEEXZKPVZFY-KGLIPLIRSA-N 0 3 266.429 2.755 20 70 CFIDHN CC(C)[C@@H](O)CNCc1ccc(F)c(C(F)(F)F)c1 ZINC000160150364 188457438 /nfs/dbraw/zinc/45/74/38/188457438.db2.gz OBRZMJJBROKKQH-LBPRGKRZSA-N 0 3 279.277 2.951 20 70 CFIDHN Cc1ccc2cc(C(=O)N3CCC[C@@H](N(C)C)C3)ccc2n1 ZINC000161480937 188529831 /nfs/dbraw/zinc/52/98/31/188529831.db2.gz ICLUPDHMLXUCIT-MRXNPFEDSA-N 0 3 297.402 2.709 20 70 CFIDHN CCCn1nccc1CN[C@H](C)CCc1ccco1 ZINC000159985587 540666280 /nfs/dbraw/zinc/66/62/80/540666280.db2.gz OQELPGWDLDRVGF-CYBMUJFWSA-N 0 3 261.369 2.997 20 70 CFIDHN CC(C)[C@@H]1CCN(C(=O)Nc2cccc(CN)c2)C1 ZINC000160979648 540685258 /nfs/dbraw/zinc/68/52/58/540685258.db2.gz UGPWERZOIOIXDZ-CYBMUJFWSA-N 0 3 261.369 2.655 20 70 CFIDHN Cc1cccc([C@H]2CCCN2CCCc2cnn(C)c2)n1 ZINC000159819658 541012861 /nfs/dbraw/zinc/01/28/61/541012861.db2.gz MUQKIQGEBIGENZ-QGZVFWFLSA-N 0 3 284.407 2.893 20 70 CFIDHN CCN(CC)C(=O)[C@@H](NC1CC=CC1)c1ccccc1 ZINC000160892978 541491858 /nfs/dbraw/zinc/49/18/58/541491858.db2.gz YGUKUVOKNVSOAP-INIZCTEOSA-N 0 3 272.392 2.904 20 70 CFIDHN C[C@]1(c2ccccc2)CCCN(C(=O)[C@H]2CCCCN2)C1 ZINC000160101763 378748813 /nfs/dbraw/zinc/74/88/13/378748813.db2.gz FMMPMSHSWKMAOQ-AEFFLSMTSA-N 0 3 286.419 2.709 20 70 CFIDHN Cc1cnc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)nc1 ZINC000160223271 378758076 /nfs/dbraw/zinc/75/80/76/378758076.db2.gz QONXQTKAWRRZHA-HOCLYGCPSA-N 0 3 282.391 2.717 20 70 CFIDHN CCOC(C)(C)CNCc1cn2cc(Cl)ccc2n1 ZINC000159382235 378705294 /nfs/dbraw/zinc/70/52/94/378705294.db2.gz OQZYSNOHUFWNLV-UHFFFAOYSA-N 0 3 281.787 2.892 20 70 CFIDHN CCc1nc(CN2C[C@@H](c3ccccc3)C(C)(C)C2)n[nH]1 ZINC000159369946 378705791 /nfs/dbraw/zinc/70/57/91/378705791.db2.gz VIUOPMIENGURBF-AWEZNQCLSA-N 0 3 284.407 2.993 20 70 CFIDHN C[C@@H](O)CN(C)[C@@H](C)c1cccc(Br)c1 ZINC000159399521 378706875 /nfs/dbraw/zinc/70/68/75/378706875.db2.gz BWSOHOQKCFZZLB-ZJUUUORDSA-N 0 3 272.186 2.823 20 70 CFIDHN CCc1ccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)o1 ZINC000159596074 378719024 /nfs/dbraw/zinc/71/90/24/378719024.db2.gz XXPZYUMOZCROQU-ILXRZTDVSA-N 0 3 261.365 2.889 20 70 CFIDHN CCC(CC)(CNCc1cnc(Cl)s1)C(=O)OC ZINC000159660013 378722447 /nfs/dbraw/zinc/72/24/47/378722447.db2.gz DVGWSTWTGOOEKA-UHFFFAOYSA-N 0 3 290.816 2.866 20 70 CFIDHN C[C@H](CN[C@H](C)c1cnn(C)c1)N1CCc2ccccc2C1 ZINC000159809355 378732374 /nfs/dbraw/zinc/73/23/74/378732374.db2.gz DWCYNWDWOZWLKH-HUUCEWRRSA-N 0 3 298.434 2.518 20 70 CFIDHN CCC[C@H](N)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000159811359 378732386 /nfs/dbraw/zinc/73/23/86/378732386.db2.gz HZOMLMNITPCLER-JSGCOSHPSA-N 0 3 280.799 2.783 20 70 CFIDHN CC1(C)C[C@H](NCc2cccc3c2OCCCO3)CCO1 ZINC000160540563 378781117 /nfs/dbraw/zinc/78/11/17/378781117.db2.gz FRJBPQQLNYXUSG-CQSZACIVSA-N 0 3 291.391 2.895 20 70 CFIDHN C[C@H](NCC(C)(C)O)c1ccc(F)cc1OC(F)F ZINC000160650657 378790081 /nfs/dbraw/zinc/79/00/81/378790081.db2.gz GOVPIJSXJWAQOC-QMMMGPOBSA-N 0 3 277.286 2.849 20 70 CFIDHN C[C@H](CN[C@H](C)c1cnn(C)c1)N(C)Cc1ccccc1 ZINC000160866585 378806011 /nfs/dbraw/zinc/80/60/11/378806011.db2.gz WMGHNYFKUHKADC-HUUCEWRRSA-N 0 3 286.423 2.591 20 70 CFIDHN CC(=O)NC1CCC(Nc2cccc(CN(C)C)c2)CC1 ZINC000161092509 378821847 /nfs/dbraw/zinc/82/18/47/378821847.db2.gz CKDQGIZITQLFAR-UHFFFAOYSA-N 0 3 289.423 2.607 20 70 CFIDHN CNCC(=O)N1CCCC[C@H]1c1cccc(C)c1C ZINC000161337348 378841482 /nfs/dbraw/zinc/84/14/82/378841482.db2.gz XJOOPLMPIQLNLI-HNNXBMFYSA-N 0 3 260.381 2.576 20 70 CFIDHN Cc1ccc(NC(=O)[C@H](C)N)cc1OCCC(C)C ZINC000161509305 378852819 /nfs/dbraw/zinc/85/28/19/378852819.db2.gz RIXGGRONWOANJS-LBPRGKRZSA-N 0 3 264.369 2.706 20 70 CFIDHN CCCNC(=O)CNC/C(C)=C/c1ccc(Cl)cc1 ZINC000159893016 322329849 /nfs/dbraw/zinc/32/98/49/322329849.db2.gz QCVRPYRQQDCOAJ-FMIVXFBMSA-N 0 3 280.799 2.859 20 70 CFIDHN CCCCN(C[C@@H]1CC=CCC1)[C@@H]1CCS(=O)(=O)C1 ZINC000160758517 322342115 /nfs/dbraw/zinc/34/21/15/322342115.db2.gz UCUOUQZMFDNOCQ-HUUCEWRRSA-N 0 3 285.453 2.632 20 70 CFIDHN CSC[C@](C)(O)CNCc1ccc(C(F)(F)F)cc1 ZINC000217856242 382788061 /nfs/dbraw/zinc/78/80/61/382788061.db2.gz VEXBZUUDMIZLOO-GFCCVEGCSA-N 0 3 293.354 2.909 20 70 CFIDHN CC(C)(C)OC(=O)NCCN[C@H]1CCc2c1cccc2F ZINC000218157044 382789231 /nfs/dbraw/zinc/78/92/31/382789231.db2.gz QABXYZDJULYICW-AWEZNQCLSA-N 0 3 294.370 2.927 20 70 CFIDHN CC[C@H](N)C(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000160082147 394366081 /nfs/dbraw/zinc/36/60/81/394366081.db2.gz GAPFCRPCUHQPEG-WDEREUQCSA-N 0 3 287.190 2.834 20 70 CFIDHN COCC[C@](C)(O)CN[C@@H](C)c1ccc(Cl)c(F)c1 ZINC000218252186 397620661 /nfs/dbraw/zinc/62/06/61/397620661.db2.gz ZQWBLVGOUVVODU-HZMBPMFUSA-N 0 3 289.778 2.917 20 70 CFIDHN CC(C)(O)CN[C@H]1CCCOc2c(Cl)cccc21 ZINC000160603210 277317565 /nfs/dbraw/zinc/31/75/65/277317565.db2.gz NVFKHOBVXZFZTN-LBPRGKRZSA-N 0 3 269.772 2.914 20 70 CFIDHN C[C@@H]1CCC[C@@H](C(=O)NC2CCN(C3CC3)CC2)C1 ZINC000159370577 322321700 /nfs/dbraw/zinc/32/17/00/322321700.db2.gz YJQQMHMAVRSMOJ-CHWSQXEVSA-N 0 3 264.413 2.556 20 70 CFIDHN CN1CCC[C@H](CNC(=O)CC/C=C/c2ccccc2)C1 ZINC000159506456 322323300 /nfs/dbraw/zinc/32/33/00/322323300.db2.gz APLWBVCANVPUCA-JSNVTFDYSA-N 0 3 286.419 2.938 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)NCc1ccccc1F ZINC000159613740 322325192 /nfs/dbraw/zinc/32/51/92/322325192.db2.gz LNAQLHLZZCGTPN-BBRMVZONSA-N 0 3 290.382 2.706 20 70 CFIDHN Cc1cccc([C@H](C)C(=O)NCCN2CCC[C@H](C)C2)c1 ZINC000159903869 322330000 /nfs/dbraw/zinc/33/00/00/322330000.db2.gz AMWNOSMAEZXXQP-HOTGVXAUSA-N 0 3 288.435 2.947 20 70 CFIDHN CCN(CC(C)C)C(=O)c1ccc(CN(C)C)cc1 ZINC000159923675 322330261 /nfs/dbraw/zinc/33/02/61/322330261.db2.gz LAUPFMIFRKDVIC-UHFFFAOYSA-N 0 3 262.397 2.866 20 70 CFIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1c(C)nn(C)c1C ZINC000160560992 322339387 /nfs/dbraw/zinc/33/93/87/322339387.db2.gz HFWFKTLXRUAPQC-FZMZJTMJSA-N 0 3 294.443 2.732 20 70 CFIDHN Cc1cnc(CNC(C)(C)CN(C)Cc2ccccc2)o1 ZINC000160928471 322344667 /nfs/dbraw/zinc/34/46/67/322344667.db2.gz FBJAEEIGPXBVLI-UHFFFAOYSA-N 0 3 287.407 2.983 20 70 CFIDHN C[C@@H](NC[C@H]1CCc2ccccc21)c1cnccn1 ZINC000160973288 322345364 /nfs/dbraw/zinc/34/53/64/322345364.db2.gz WGKSUKLEADHCLC-TZMCWYRMSA-N 0 3 253.349 2.857 20 70 CFIDHN CC(C)[C@@H](N)C(=O)Nc1cc(C2CCCCCC2)[nH]n1 ZINC000161071913 322347165 /nfs/dbraw/zinc/34/71/65/322347165.db2.gz PYQXBDFHTDBZHD-CQSZACIVSA-N 0 3 278.400 2.769 20 70 CFIDHN C[C@H](NCCc1ccc2c(c1)OCO2)c1cncc(F)c1 ZINC000161140395 322348108 /nfs/dbraw/zinc/34/81/08/322348108.db2.gz CVCLURJXPADEJE-NSHDSACASA-N 0 3 288.322 2.843 20 70 CFIDHN Cc1c(CN(CCc2nccs2)C(C)C)cnn1C ZINC000159956182 533844884 /nfs/dbraw/zinc/84/48/84/533844884.db2.gz IMWBWCZYJIGIDO-UHFFFAOYSA-N 0 3 278.425 2.638 20 70 CFIDHN CC(C)CC[C@](C)(O)CN[C@@H](C)c1cncs1 ZINC000159365813 519695886 /nfs/dbraw/zinc/69/58/86/519695886.db2.gz MRGPMLHPNGRZGC-AAEUAGOBSA-N 0 3 256.415 2.981 20 70 CFIDHN CC(C)NC(=O)CN[C@H](C)c1cccc(-c2ccncc2)c1 ZINC000161005291 519708875 /nfs/dbraw/zinc/70/88/75/519708875.db2.gz QPDRMJXPRVXPSI-CQSZACIVSA-N 0 3 297.402 2.924 20 70 CFIDHN CCO[C@@H]1C[C@@H](NCc2cc(OC)ccc2OC)C1(C)C ZINC000217893675 520368288 /nfs/dbraw/zinc/36/82/88/520368288.db2.gz NTRVHCLJYIFGES-HZPDHXFCSA-N 0 3 293.407 2.997 20 70 CFIDHN CC1(C)C[C@@H](NCC[S@@](=O)c2ccccc2)C(C)(C)O1 ZINC000160787783 520525261 /nfs/dbraw/zinc/52/52/61/520525261.db2.gz JALFFFIYLOPXHO-VLIAUNLRSA-N 0 3 295.448 2.730 20 70 CFIDHN CC[C@@H](C)c1cc(C(=O)NC2CCN(C3CC3)CC2)on1 ZINC000159373131 522417003 /nfs/dbraw/zinc/41/70/03/522417003.db2.gz TYQWWLUNESIZDP-LLVKDONJSA-N 0 3 291.395 2.545 20 70 CFIDHN COC(CN1CCC(c2ccc(F)cc2)CC1)OC ZINC000161484047 522529070 /nfs/dbraw/zinc/52/90/70/522529070.db2.gz NFWTVHJWRWYSKY-UHFFFAOYSA-N 0 3 267.344 2.624 20 70 CFIDHN COC(CN1CC[C@H](c2ccccc2)[C@@H](C)C1)OC ZINC000161255322 522533956 /nfs/dbraw/zinc/53/39/56/522533956.db2.gz LCKNAHKVQZQYDN-ZFWWWQNUSA-N 0 3 263.381 2.731 20 70 CFIDHN CN1CCC(Oc2ccc(NCc3ccccn3)cn2)CC1 ZINC000160153917 523782747 /nfs/dbraw/zinc/78/27/47/523782747.db2.gz KJXQEFMBWNAUIM-UHFFFAOYSA-N 0 3 298.390 2.562 20 70 CFIDHN COc1ccc(CNC[C@@H]2CCC(C)(C)O2)cc1OC ZINC000160215637 524071768 /nfs/dbraw/zinc/07/17/68/524071768.db2.gz QXJVTVBKHLXJLR-ZDUSSCGKSA-N 0 3 279.380 2.751 20 70 CFIDHN Cc1ccc(C)c(OCCCN2CCC(C)(O)CC2)c1 ZINC000161196068 524174660 /nfs/dbraw/zinc/17/46/60/524174660.db2.gz TXMIWPGKBIMJDO-UHFFFAOYSA-N 0 3 277.408 2.919 20 70 CFIDHN C[C@H]1CCC[C@H](C(=O)NCCN2CCC[C@H](C)C2)C1 ZINC000160587387 524177050 /nfs/dbraw/zinc/17/70/50/524177050.db2.gz DDTYMFRWJHNQQV-KKUMJFAQSA-N 0 3 266.429 2.661 20 70 CFIDHN COc1ccc([C@@H](C)N[C@H](CCO)CSC)cc1F ZINC000160218738 525163228 /nfs/dbraw/zinc/16/32/28/525163228.db2.gz LWYJXAHKJKWYOI-ZYHUDNBSSA-N 0 3 287.400 2.599 20 70 CFIDHN CC(C)CC1(CNC(=O)N(CCN(C)C)C(C)C)CC1 ZINC000159586489 527692388 /nfs/dbraw/zinc/69/23/88/527692388.db2.gz CLULAUMBVMIZOQ-UHFFFAOYSA-N 0 3 283.460 2.794 20 70 CFIDHN CCOCCCN1CCN(c2ccc(Cl)cc2)CC1 ZINC000159678023 528662371 /nfs/dbraw/zinc/66/23/71/528662371.db2.gz ZLPLBBKOUXGFQA-UHFFFAOYSA-N 0 3 282.815 2.889 20 70 CFIDHN CC[C@@H]1CCC[C@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159596783 529320721 /nfs/dbraw/zinc/32/07/21/529320721.db2.gz QJDQYFWSHDUCDD-ZIAGYGMSSA-N 0 3 269.433 2.547 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cc(F)cc(F)c1)CC2 ZINC000160456742 282118364 /nfs/dbraw/zinc/11/83/64/282118364.db2.gz CIIWJYHUSVXHPK-OTYXRUKQSA-N 0 3 292.333 2.530 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(C)cc1)CC2 ZINC000160548039 282125431 /nfs/dbraw/zinc/12/54/31/282125431.db2.gz WIWBNOMEQAFQGQ-SWLSCSKDSA-N 0 3 270.380 2.561 20 70 CFIDHN CN1CCC[C@@H]1CNC(=O)CC/C=C/c1ccccc1 ZINC000160126988 530057340 /nfs/dbraw/zinc/05/73/40/530057340.db2.gz USRFJUAUBPBLPX-ZWIJEDICSA-N 0 3 272.392 2.690 20 70 CFIDHN CCc1ccc([C@H](C)CC(=O)NC[C@H]2CCCN2C)cc1 ZINC000160134297 348015895 /nfs/dbraw/zinc/01/58/95/348015895.db2.gz KPOKJBCSPOHBPX-RHSMWYFYSA-N 0 3 288.435 2.953 20 70 CFIDHN CCc1ccc([C@@H](C)CC(=O)NC[C@@H]2CCCN2C)cc1 ZINC000160133867 348015962 /nfs/dbraw/zinc/01/59/62/348015962.db2.gz KPOKJBCSPOHBPX-YOEHRIQHSA-N 0 3 288.435 2.953 20 70 CFIDHN CCc1ccc([C@H](C)CC(=O)NCCN(C)CC)cc1 ZINC000160148745 348016103 /nfs/dbraw/zinc/01/61/03/348016103.db2.gz ZGTJYWWAJDKHIM-CQSZACIVSA-N 0 3 276.424 2.811 20 70 CFIDHN CC(C)CCN(C(=O)N[C@H]1CCN(CC2CC2)C1)C1CC1 ZINC000160634526 348019080 /nfs/dbraw/zinc/01/90/80/348019080.db2.gz TZRJQBNERIKQAW-HNNXBMFYSA-N 0 3 293.455 2.691 20 70 CFIDHN CCCCSCCC(=O)N[C@@H](C)CN1CCCCC1 ZINC000159751429 282882953 /nfs/dbraw/zinc/88/29/53/282882953.db2.gz KSPJZCRIVFBPIO-AWEZNQCLSA-N 0 3 286.485 2.900 20 70 CFIDHN Cc1cc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)c(C)s1 ZINC000160332949 188466558 /nfs/dbraw/zinc/46/65/58/188466558.db2.gz FVRANQVEUGJKTC-MFKMUULPSA-N 0 3 290.436 2.930 20 70 CFIDHN Cc1cn2c(CNCC3(CO)CCCC3)c(C)nc2s1 ZINC000160102959 540542507 /nfs/dbraw/zinc/54/25/07/540542507.db2.gz UHXIMTZDTLYXAC-UHFFFAOYSA-N 0 3 293.436 2.655 20 70 CFIDHN CCCn1nccc1CNCCc1ccc(OC)cc1 ZINC000159959200 540665879 /nfs/dbraw/zinc/66/58/79/540665879.db2.gz ASAMIERDKFEYHU-UHFFFAOYSA-N 0 3 273.380 2.634 20 70 CFIDHN C[C@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159386387 540992045 /nfs/dbraw/zinc/99/20/45/540992045.db2.gz IJHOBHKXTZMPJI-DZGCQCFKSA-N 0 3 287.407 2.523 20 70 CFIDHN C[C@H](CC(=O)N(C)[C@@H]1CCN(C)[C@H](C)C1)c1ccncc1 ZINC000160789724 541479601 /nfs/dbraw/zinc/47/96/01/541479601.db2.gz BEQPFTVOWOETFF-IIAWOOMASA-N 0 3 289.423 2.516 20 70 CFIDHN COc1ccc([C@H](C)N(C)CCCCS(C)(=O)=O)cc1 ZINC000161335043 541590334 /nfs/dbraw/zinc/59/03/34/541590334.db2.gz GUTJGSOEYBCQMT-ZDUSSCGKSA-N 0 3 299.436 2.513 20 70 CFIDHN CS[C@H](C)CC(=O)Nc1ccc(OCCN(C)C)cc1 ZINC000160219498 378757218 /nfs/dbraw/zinc/75/72/18/378757218.db2.gz OXFRDQXGYOEBRJ-GFCCVEGCSA-N 0 3 296.436 2.707 20 70 CFIDHN CCn1cc([C@H](C)NC[C@@](C)(O)c2ccsc2)cn1 ZINC000160025049 378743572 /nfs/dbraw/zinc/74/35/72/378743572.db2.gz ZYDONWLHXUXNNI-SMDDNHRTSA-N 0 3 279.409 2.523 20 70 CFIDHN O=C(CNCC1CC1)N1CC2(CCCC2)c2ccccc21 ZINC000159368834 378705012 /nfs/dbraw/zinc/70/50/12/378705012.db2.gz GHCGZNQKZHVLJF-UHFFFAOYSA-N 0 3 284.403 2.845 20 70 CFIDHN Cc1nnc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000160214495 378756207 /nfs/dbraw/zinc/75/62/07/378756207.db2.gz BOVKWURUPULDSO-FZMZJTMJSA-N 0 3 288.420 2.779 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000159721685 378726075 /nfs/dbraw/zinc/72/60/75/378726075.db2.gz MFVHNVDHLDAEBG-RBSFLKMASA-N 0 3 260.381 2.566 20 70 CFIDHN Cc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCCC2)c(C)c1 ZINC000159728875 378727988 /nfs/dbraw/zinc/72/79/88/378727988.db2.gz GREHKWPMUCTKOT-GJZGRUSLSA-N 0 3 274.408 2.965 20 70 CFIDHN C[C@@H](N[C@H](CC(N)=O)C1CCCCC1)c1ccccn1 ZINC000159752044 378729018 /nfs/dbraw/zinc/72/90/18/378729018.db2.gz KZDKMIQYLKWEBO-IUODEOHRSA-N 0 3 275.396 2.557 20 70 CFIDHN CNCC(=O)N1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 ZINC000159780675 378730387 /nfs/dbraw/zinc/73/03/87/378730387.db2.gz HSQZOOOXOMQNBE-CZUORRHYSA-N 0 3 260.381 2.514 20 70 CFIDHN c1cn(CCN2CCSC[C@@H]2c2ccccc2)cn1 ZINC000159829878 378731369 /nfs/dbraw/zinc/73/13/69/378731369.db2.gz ITGMPQVHSUEZHE-OAHLLOKOSA-N 0 3 273.405 2.673 20 70 CFIDHN O=C([C@@H]1CCCCN1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000159805817 378731599 /nfs/dbraw/zinc/73/15/99/378731599.db2.gz JCUCUVITYKVDOO-ZFWWWQNUSA-N 0 3 292.810 2.798 20 70 CFIDHN c1cn(CCN2CCSC[C@H]2c2ccccc2)cn1 ZINC000159829761 378732169 /nfs/dbraw/zinc/73/21/69/378732169.db2.gz ITGMPQVHSUEZHE-HNNXBMFYSA-N 0 3 273.405 2.673 20 70 CFIDHN Cc1cccc(C)c1CCN[C@H](C(N)=O)c1ccccc1 ZINC000160615528 378786549 /nfs/dbraw/zinc/78/65/49/378786549.db2.gz BTQVEWLUHUKDOO-KRWDZBQOSA-N 0 3 282.387 2.662 20 70 CFIDHN COc1cc(OC)c([C@H](C)NCC(C)(C)O)cc1Cl ZINC000160642572 378788490 /nfs/dbraw/zinc/78/84/90/378788490.db2.gz NOKIFWDSZIBCGF-VIFPVBQESA-N 0 3 287.787 2.779 20 70 CFIDHN COc1ccc(Cl)cc1[C@H](C)NCC(C)(C)O ZINC000160643649 378788507 /nfs/dbraw/zinc/78/85/07/378788507.db2.gz JVHQBCRUAMRADV-VIFPVBQESA-N 0 3 257.761 2.770 20 70 CFIDHN C[C@H]1C[C@@H](Nc2cnccn2)CN1Cc1ccccc1 ZINC000160930840 378809262 /nfs/dbraw/zinc/80/92/62/378809262.db2.gz MSQYLGMPNVDXRE-DZGCQCFKSA-N 0 3 268.364 2.552 20 70 CFIDHN CC(C)NC(=O)CN[C@@H]1c2cccc(F)c2CC[C@H]1C ZINC000160914948 378809692 /nfs/dbraw/zinc/80/96/92/378809692.db2.gz FCUCKEVGLNOIOF-BZNIZROVSA-N 0 3 278.371 2.563 20 70 CFIDHN CC[C@H](C)OCC(=O)Nc1cc(CN(C)C)ccc1C ZINC000160942561 378810921 /nfs/dbraw/zinc/81/09/21/378810921.db2.gz RNPWXBTWHJTDGC-ZDUSSCGKSA-N 0 3 278.396 2.810 20 70 CFIDHN Cc1ccc(CN[C@H](C)c2ccc(-n3cnnn3)cc2)s1 ZINC000160944251 378811926 /nfs/dbraw/zinc/81/19/26/378811926.db2.gz DKCKBPNVMYYLKR-GFCCVEGCSA-N 0 3 299.403 2.883 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000161054951 378818210 /nfs/dbraw/zinc/81/82/10/378818210.db2.gz TYMSFHKSOZJNNX-PMPSAXMXSA-N 0 3 274.408 2.641 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000161152064 378826317 /nfs/dbraw/zinc/82/63/17/378826317.db2.gz QCLUMPYVQIRWJI-QPUJVOFHSA-N 0 3 272.751 2.784 20 70 CFIDHN COc1ccc2c(c1)CCC[C@H]2NCc1cnn(C)c1C ZINC000161312919 378839381 /nfs/dbraw/zinc/83/93/81/378839381.db2.gz NEDBEJVXFLZOEV-QGZVFWFLSA-N 0 3 285.391 2.904 20 70 CFIDHN CCOCCN[C@@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000161471470 378849261 /nfs/dbraw/zinc/84/92/61/378849261.db2.gz SIVOKZJKFQTGTP-MRXNPFEDSA-N 0 3 279.380 2.781 20 70 CFIDHN CC[C@H](C)[C@@H](N)C(=O)N1CCC[C@H](CC(C)C)C1 ZINC000161475350 378849682 /nfs/dbraw/zinc/84/96/82/378849682.db2.gz MTDGSVGVFGHMTQ-BFHYXJOUSA-N 0 3 254.418 2.645 20 70 CFIDHN C[C@H]1CCC[C@H](C(=O)NC2CCN(C3CC3)CC2)C1 ZINC000159370451 322321683 /nfs/dbraw/zinc/32/16/83/322321683.db2.gz YJQQMHMAVRSMOJ-STQMWFEESA-N 0 3 264.413 2.556 20 70 CFIDHN CC(C)C(=O)NCCCN[C@@H](C)c1ccc(F)cc1F ZINC000159974752 322330889 /nfs/dbraw/zinc/33/08/89/322330889.db2.gz SJUBSMYMJRBACU-NSHDSACASA-N 0 3 284.350 2.778 20 70 CFIDHN C[C@H](NCC12CC3CC(CC(C3)C1)C2)c1nncn1C ZINC000216824502 382784780 /nfs/dbraw/zinc/78/47/80/382784780.db2.gz BMDXFFPPHPSLQO-IKMFHRHGSA-N 0 3 274.412 2.682 20 70 CFIDHN CSC[C@@](C)(O)CNCc1ccc(OC(C)C)cc1 ZINC000217866074 382788048 /nfs/dbraw/zinc/78/80/48/382788048.db2.gz BJYOVZWVZUIAAH-HNNXBMFYSA-N 0 3 283.437 2.677 20 70 CFIDHN CCN(Cc1ccncc1)C[C@@H](O)c1ccccc1F ZINC000218153457 382789284 /nfs/dbraw/zinc/78/92/84/382789284.db2.gz XCBJZKAIOAEHDR-MRXNPFEDSA-N 0 3 274.339 2.776 20 70 CFIDHN Cc1cc(C)cc([C@H](C)NCC(=O)NCC(F)(F)F)c1 ZINC000160519505 394366475 /nfs/dbraw/zinc/36/64/75/394366475.db2.gz QCLSMAXFFMKMKU-NSHDSACASA-N 0 3 288.313 2.633 20 70 CFIDHN CC(C)(C)NC(=O)N1CCC[C@H](NCc2ccccc2)C1 ZINC000161101052 394367277 /nfs/dbraw/zinc/36/72/77/394367277.db2.gz ATYACOUOFSOYNX-HNNXBMFYSA-N 0 3 289.423 2.749 20 70 CFIDHN COCC[C@@](C)(O)CN[C@H](C)c1ccc(Cl)c(F)c1 ZINC000218252268 397620997 /nfs/dbraw/zinc/62/09/97/397620997.db2.gz ZQWBLVGOUVVODU-QMTHXVAHSA-N 0 3 289.778 2.917 20 70 CFIDHN CC(C)[C@H](CNCc1ccn(C)n1)c1ccccc1 ZINC000218094037 397621067 /nfs/dbraw/zinc/62/10/67/397621067.db2.gz OYMYPXOTZLGYPK-INIZCTEOSA-N 0 3 257.381 2.950 20 70 CFIDHN CCc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1 ZINC000160332578 273770588 /nfs/dbraw/zinc/77/05/88/273770588.db2.gz ZIPOWMFLYRODMU-LRDDRELGSA-N 0 3 284.407 2.815 20 70 CFIDHN CC(C)C[C@H]1CCN(C(=O)C2(N)CCCCC2)C1 ZINC000159613212 275919155 /nfs/dbraw/zinc/91/91/55/275919155.db2.gz OBQBFGVLDFNTME-CYBMUJFWSA-N 0 3 252.402 2.543 20 70 CFIDHN CCN1CCCN(C(=O)NC2CCC(C)(C)CC2)CC1 ZINC000159902218 279284762 /nfs/dbraw/zinc/28/47/62/279284762.db2.gz ORMQEBLBJSRSPC-UHFFFAOYSA-N 0 3 281.444 2.692 20 70 CFIDHN C[C@H](CN[C@@H](C)c1cnn(C)c1)N(C)Cc1ccccc1 ZINC000160866323 279348367 /nfs/dbraw/zinc/34/83/67/279348367.db2.gz WMGHNYFKUHKADC-CABCVRRESA-N 0 3 286.423 2.591 20 70 CFIDHN COc1ccc(C)cc1CN(C)C[C@@H]1CCC[C@@H]1O ZINC000159458728 322323177 /nfs/dbraw/zinc/32/31/77/322323177.db2.gz QXXJZDRJRWCXOM-ZFWWWQNUSA-N 0 3 263.381 2.596 20 70 CFIDHN CC[C@@H](c1ccc(Cl)cc1)N(C)CC(C)(CO)CO ZINC000159575241 322324621 /nfs/dbraw/zinc/32/46/21/322324621.db2.gz MEUDHODBVZFVHM-AWEZNQCLSA-N 0 3 285.815 2.714 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)NCc1ccc(F)cc1 ZINC000159669231 322326349 /nfs/dbraw/zinc/32/63/49/322326349.db2.gz CHGJMUQRSSFDAU-HOCLYGCPSA-N 0 3 290.382 2.706 20 70 CFIDHN Cc1nc2ccccn2c1CN1C[C@@H](C)S[C@H](C)C1 ZINC000160815262 322343343 /nfs/dbraw/zinc/34/33/43/322343343.db2.gz NNZBKZKAGJBPPE-VXGBXAGGSA-N 0 3 275.421 2.969 20 70 CFIDHN CCCN(CCO)Cc1c[nH]nc1-c1ccc(Cl)cc1 ZINC000161212835 322348896 /nfs/dbraw/zinc/34/88/96/322348896.db2.gz DURIEPLYJZQHMB-UHFFFAOYSA-N 0 3 293.798 2.934 20 70 CFIDHN CCCN(CCO)Cc1cccc2c1OC(C)(C)C2 ZINC000161210974 322348913 /nfs/dbraw/zinc/34/89/13/322348913.db2.gz SGWZRGFZJPVLAG-UHFFFAOYSA-N 0 3 263.381 2.604 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H](C)CCC(C)C)CC1 ZINC000159514554 521610228 /nfs/dbraw/zinc/61/02/28/521610228.db2.gz LAVXDAIMJLUBGY-CQSZACIVSA-N 0 3 269.433 2.548 20 70 CFIDHN COC(CN1CCC(c2nc3ccccc3o2)CC1)OC ZINC000160508142 522530836 /nfs/dbraw/zinc/53/08/36/522530836.db2.gz AHGHCZKMZRWJTO-UHFFFAOYSA-N 0 3 290.363 2.626 20 70 CFIDHN CC[C@@H](NC(=O)N1CCCN(CC)CC1)c1cccs1 ZINC000159722236 522709453 /nfs/dbraw/zinc/70/94/53/522709453.db2.gz FPHLMIAGAMKWMJ-CYBMUJFWSA-N 0 3 295.452 2.936 20 70 CFIDHN CC[C@H](N[C@H](CCO)CSC)c1ccccc1OC ZINC000160375394 522743554 /nfs/dbraw/zinc/74/35/54/522743554.db2.gz JRBRVYYUXKVODF-OCCSQVGLSA-N 0 3 283.437 2.850 20 70 CFIDHN COc1cc([C@H](C)N[C@H](C)[C@@H](CO)SC)ccc1F ZINC000218255865 522947369 /nfs/dbraw/zinc/94/73/69/522947369.db2.gz LQVLGZYOUZKQLL-IMSIIYSGSA-N 0 3 287.400 2.597 20 70 CFIDHN C[C@H]1CCC[C@@H](C(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000160578782 524127457 /nfs/dbraw/zinc/12/74/57/524127457.db2.gz PYJCCNULNVXIDJ-SOUVJXGZSA-N 0 3 266.429 2.803 20 70 CFIDHN Cc1ccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)cc1 ZINC000161406693 524452204 /nfs/dbraw/zinc/45/22/04/524452204.db2.gz UZRBWCNFZGRNCR-INIZCTEOSA-N 0 3 296.418 2.912 20 70 CFIDHN Cc1cccc([C@@H]2CCCCCN2C(=O)[C@@H](C)N)c1 ZINC000160984199 524841488 /nfs/dbraw/zinc/84/14/88/524841488.db2.gz SMCCYTNIFZPSIR-HIFRSBDPSA-N 0 3 260.381 2.786 20 70 CFIDHN C[C@@H]1C[C@@H](N(C)c2nc(C(C)(C)C)ns2)CCN1C ZINC000159624509 525246211 /nfs/dbraw/zinc/24/62/11/525246211.db2.gz MHUHMTQUFZENDL-MNOVXSKESA-N 0 3 282.457 2.755 20 70 CFIDHN COc1ccc([C@H](C)NCC2(CO)CCCC2)c(OC)c1 ZINC000160073567 525317660 /nfs/dbraw/zinc/31/76/60/525317660.db2.gz WMNVFFSFGMQPRX-ZDUSSCGKSA-N 0 3 293.407 2.907 20 70 CFIDHN C[C@@H](NCc1cccc2cc[nH]c21)C(=O)N1CCCCC1 ZINC000218126159 525535071 /nfs/dbraw/zinc/53/50/71/525535071.db2.gz WEPINXUKEJCBQI-CYBMUJFWSA-N 0 3 285.391 2.659 20 70 CFIDHN Cc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)s1 ZINC000160303245 525750517 /nfs/dbraw/zinc/75/05/17/525750517.db2.gz TWNOGJYLIZFOQH-PWSUYJOCSA-N 0 3 276.409 2.622 20 70 CFIDHN Cc1c2cc(C)ccc2[nH]c1C(=O)N(C)[C@H]1CCCN(C)C1 ZINC000159917821 525944227 /nfs/dbraw/zinc/94/42/27/525944227.db2.gz BHFXCWKVZDBGFI-AWEZNQCLSA-N 0 3 299.418 2.951 20 70 CFIDHN Cc1ccc(C(=O)CCN(CCCCO)C2CC2)cc1 ZINC000159797460 526040814 /nfs/dbraw/zinc/04/08/14/526040814.db2.gz AZGCMJDOMZWTQN-UHFFFAOYSA-N 0 3 275.392 2.805 20 70 CFIDHN OC1(CNCc2ccc(F)c(C(F)(F)F)c2)CCC1 ZINC000160148115 527508621 /nfs/dbraw/zinc/50/86/21/527508621.db2.gz MQQFYBYQXPCHOV-UHFFFAOYSA-N 0 3 277.261 2.849 20 70 CFIDHN OCC1(CNCc2cnn(-c3ccccc3)c2)CCCC1 ZINC000160076452 527523831 /nfs/dbraw/zinc/52/38/31/527523831.db2.gz OYHZGMRDFNMEKQ-UHFFFAOYSA-N 0 3 285.391 2.515 20 70 CFIDHN FC(F)(F)CCNCc1cncc(Br)c1 ZINC000160575543 527665664 /nfs/dbraw/zinc/66/56/64/527665664.db2.gz MDACYUWLYXABCD-UHFFFAOYSA-N 0 3 283.091 2.886 20 70 CFIDHN CC1(O)CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000161206991 528042896 /nfs/dbraw/zinc/04/28/96/528042896.db2.gz MGZQUCIBIJTOKB-UHFFFAOYSA-N 0 3 289.297 2.932 20 70 CFIDHN CCCN1CCC[C@H]1C(=O)NCCc1cc2ccccc2[nH]1 ZINC000160948990 528229816 /nfs/dbraw/zinc/22/98/16/528229816.db2.gz RKEPJPAIWRYQCI-KRWDZBQOSA-N 0 3 299.418 2.701 20 70 CFIDHN CCCCc1ccc([C@H](C)N[C@@H](C)CC(N)=O)cc1 ZINC000161359268 529028763 /nfs/dbraw/zinc/02/87/63/529028763.db2.gz JRHKFPYIDJDOMM-STQMWFEESA-N 0 3 262.397 2.944 20 70 CFIDHN c1csc([C@H]2CCCN(CCOCC3CC3)C2)n1 ZINC000160001059 232246989 /nfs/dbraw/zinc/24/69/89/232246989.db2.gz KQHSDJPAFFFBSD-ZDUSSCGKSA-N 0 3 266.410 2.749 20 70 CFIDHN CCCCN(C)CCNC(=O)[C@@H](C)Cc1ccccc1F ZINC000159951391 348014937 /nfs/dbraw/zinc/01/49/37/348014937.db2.gz PFAQKNLXKKNLSB-AWEZNQCLSA-N 0 3 294.414 2.852 20 70 CFIDHN CC[C@@H](CC(=O)NCCN(C)CC)c1ccc(C)cc1 ZINC000160146698 348016026 /nfs/dbraw/zinc/01/60/26/348016026.db2.gz MJFNQQFSPGGLGD-HNNXBMFYSA-N 0 3 276.424 2.947 20 70 CFIDHN CSCC[C@H](C)N(C)C(=O)c1cccc2c1CCNC2 ZINC000161258576 348024019 /nfs/dbraw/zinc/02/40/19/348024019.db2.gz MAWKTVSWHYRMEB-LBPRGKRZSA-N 0 3 292.448 2.546 20 70 CFIDHN CCO[C@@H]1C[C@H](NCc2nn(C)c3ccccc23)C1(C)C ZINC000217879820 348165875 /nfs/dbraw/zinc/16/58/75/348165875.db2.gz CKQVJJGGWWUJBC-JKSUJKDBSA-N 0 3 287.407 2.867 20 70 CFIDHN CC(C)(C)n1cc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cn1 ZINC000159465598 540994040 /nfs/dbraw/zinc/99/40/40/540994040.db2.gz FKGMFHRLDGKMHN-ZNMIVQPWSA-N 0 3 289.423 2.685 20 70 CFIDHN C[C@H](CC(=O)N(C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccncc1 ZINC000160789833 541479777 /nfs/dbraw/zinc/47/97/77/541479777.db2.gz BEQPFTVOWOETFF-IJEWVQPXSA-N 0 3 289.423 2.516 20 70 CFIDHN c1ccc(OCCCN2CCN(c3ccncc3)CC2)cc1 ZINC000161288256 541578984 /nfs/dbraw/zinc/57/89/84/541578984.db2.gz DGQJWNVVLGSEGT-UHFFFAOYSA-N 0 3 297.402 2.673 20 70 CFIDHN C[C@H](N)C(=O)Nc1ccc(Cl)cc1OCC(F)(F)F ZINC000159976073 378740912 /nfs/dbraw/zinc/74/09/12/378740912.db2.gz RFGQPQHDPHKXPE-LURJTMIESA-N 0 3 296.676 2.567 20 70 CFIDHN CCOC[C@H]1CCN(CCC(=O)c2ccc(C)cc2)C1 ZINC000159987674 378741632 /nfs/dbraw/zinc/74/16/32/378741632.db2.gz DVMVMYSQRYUPIQ-HNNXBMFYSA-N 0 3 275.392 2.926 20 70 CFIDHN CN(Cc1ccc(F)c(F)c1)C[C@H]1CCC[C@@H]1O ZINC000159539376 378715552 /nfs/dbraw/zinc/71/55/52/378715552.db2.gz YSBVRDIJWNOGIF-RISCZKNCSA-N 0 3 255.308 2.558 20 70 CFIDHN Cc1ncc([C@H](C)N[C@H]2CCCSC2)c(C)n1 ZINC000159562681 378717672 /nfs/dbraw/zinc/71/76/72/378717672.db2.gz RCDLUEWKRDQYKV-JQWIXIFHSA-N 0 3 251.399 2.640 20 70 CFIDHN CN(C)[C@@H](CNCc1cc(F)cc(F)c1)c1ccco1 ZINC000159581423 378718487 /nfs/dbraw/zinc/71/84/87/378718487.db2.gz BOBDKNRTQOHCII-AWEZNQCLSA-N 0 3 280.318 2.950 20 70 CFIDHN CC[C@H](NC(=O)[C@@H]1CCCCN1)c1ccc(F)cc1F ZINC000159728178 378727501 /nfs/dbraw/zinc/72/75/01/378727501.db2.gz MLORBGCQOHISPZ-KBPBESRZSA-N 0 3 282.334 2.674 20 70 CFIDHN O=C(N1CC[C@@H](N2CCCCC2)C1)N1CCCCCC1 ZINC000160558118 378780206 /nfs/dbraw/zinc/78/02/06/378780206.db2.gz FSVWCAJXPIKIMK-OAHLLOKOSA-N 0 3 279.428 2.543 20 70 CFIDHN CC(C)COCCN[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000160704133 378793008 /nfs/dbraw/zinc/79/30/08/378793008.db2.gz ARKIENYFKGLQCJ-BFUOFWGJSA-N 0 3 283.437 2.747 20 70 CFIDHN COc1cccc([C@H](O)CN[C@H](C)c2ccco2)c1 ZINC000160791012 378797892 /nfs/dbraw/zinc/79/78/92/378797892.db2.gz DUZDQQYBPNTQDK-BXUZGUMPSA-N 0 3 261.321 2.672 20 70 CFIDHN COc1ccc(CNC(C)(C)[C@@H](C)O)c(Cl)c1OC ZINC000161130058 378824241 /nfs/dbraw/zinc/82/42/41/378824241.db2.gz HRDOLZQFRLQRCA-SECBINFHSA-N 0 3 287.787 2.606 20 70 CFIDHN Cc1ccc([C@H](C)CNC(=O)[C@@H](N)Cc2ccccc2)cc1 ZINC000161168711 378827380 /nfs/dbraw/zinc/82/73/80/378827380.db2.gz WGDSCPBOEDAWAX-QAPCUYQASA-N 0 3 296.414 2.785 20 70 CFIDHN CCOC[C@H](O)CN[C@H](C)c1ccc(SCC)cc1 ZINC000159637970 322325521 /nfs/dbraw/zinc/32/55/21/322325521.db2.gz SWQAGQCJSGUYFA-TZMCWYRMSA-N 0 3 283.437 2.847 20 70 CFIDHN C[C@H](NCCCCS(C)(=O)=O)c1ccccc1Cl ZINC000161192460 322348705 /nfs/dbraw/zinc/34/87/05/322348705.db2.gz OWMSRXBRQKOUEN-NSHDSACASA-N 0 3 289.828 2.815 20 70 CFIDHN Cc1cc(C)c(C(=O)NC[C@H]2CCCN2CC(C)C)o1 ZINC000160516189 394366656 /nfs/dbraw/zinc/36/66/56/394366656.db2.gz RIGMRUAVYAKEGQ-CQSZACIVSA-N 0 3 278.396 2.747 20 70 CFIDHN CC[C@H](N)C(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1 ZINC000161011271 394366851 /nfs/dbraw/zinc/36/68/51/394366851.db2.gz HXJPNKXXHWANMM-QWHCGFSZSA-N 0 3 298.839 2.694 20 70 CFIDHN CCOc1ccccc1CNCCNC(=O)OC(C)(C)C ZINC000218126573 397620582 /nfs/dbraw/zinc/62/05/82/397620582.db2.gz VIQVIIFUNHWGHZ-UHFFFAOYSA-N 0 3 294.395 2.700 20 70 CFIDHN Cc1nc(CCNCc2nc3ccccc3n2C)cs1 ZINC000218098647 397621118 /nfs/dbraw/zinc/62/11/18/397621118.db2.gz BIAMSQPAFVZMCB-UHFFFAOYSA-N 0 3 286.404 2.671 20 70 CFIDHN C[C@@H]1CCC[C@@H](C(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000160578672 287371908 /nfs/dbraw/zinc/37/19/08/287371908.db2.gz PYJCCNULNVXIDJ-QLFBSQMISA-N 0 3 266.429 2.803 20 70 CFIDHN CC(C)[C@@H](C(=O)N[C@@H]1CCCc2sccc21)N(C)C ZINC000160264908 275666696 /nfs/dbraw/zinc/66/66/96/275666696.db2.gz LEVGHOCHFRXUQY-OCCSQVGLSA-N 0 3 280.437 2.828 20 70 CFIDHN Cc1ncc([C@@H](C)N[C@H]2CCCSC2)c(C)n1 ZINC000159562546 279157345 /nfs/dbraw/zinc/15/73/45/279157345.db2.gz RCDLUEWKRDQYKV-PWSUYJOCSA-N 0 3 251.399 2.640 20 70 CFIDHN C[C@H]1C[C@H](NC(=O)NC(C)(C)C)CN1Cc1ccccc1 ZINC000160380753 280003930 /nfs/dbraw/zinc/00/39/30/280003930.db2.gz LEHPUYOQHDYEJS-ZFWWWQNUSA-N 0 3 289.423 2.747 20 70 CFIDHN C[C@H]1C[C@H](NCCO)c2cccc(Br)c21 ZINC000159706874 280010684 /nfs/dbraw/zinc/01/06/84/280010684.db2.gz QTXGXCJEDOVNNH-KWQFWETISA-N 0 3 270.170 2.579 20 70 CFIDHN CC[C@H](OC1CCCCC1)C(=O)NC1CCN(CC)CC1 ZINC000159588677 322324467 /nfs/dbraw/zinc/32/44/67/322324467.db2.gz LQHVCUHYRQFBOX-INIZCTEOSA-N 0 3 296.455 2.715 20 70 CFIDHN CC[C@H](OC1CCCCC1)C(=O)NC[C@@H]1CCCN1CC ZINC000159578468 322324782 /nfs/dbraw/zinc/32/47/82/322324782.db2.gz MEZQOEXTHCUHFE-HOCLYGCPSA-N 0 3 296.455 2.715 20 70 CFIDHN CC1(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1 ZINC000159669200 322326323 /nfs/dbraw/zinc/32/63/23/322326323.db2.gz BDVODNRTXIDAMQ-GFCCVEGCSA-N 0 3 278.421 2.801 20 70 CFIDHN C[C@H](NCCC(C)(C)C)c1nnnn1-c1ccccc1 ZINC000159881632 322329640 /nfs/dbraw/zinc/32/96/40/322329640.db2.gz SHRDVSQDCLSTTJ-LBPRGKRZSA-N 0 3 273.384 2.749 20 70 CFIDHN CCCCN(C)CCNC(=O)[C@@H](C)c1ccsc1 ZINC000159952300 322330788 /nfs/dbraw/zinc/33/07/88/322330788.db2.gz SWHFZJCYSXNKNR-LBPRGKRZSA-N 0 3 268.426 2.700 20 70 CFIDHN CC(C)C(=O)NCCCN[C@H](C)c1ccc(F)cc1F ZINC000159974845 322331072 /nfs/dbraw/zinc/33/10/72/322331072.db2.gz SJUBSMYMJRBACU-LLVKDONJSA-N 0 3 284.350 2.778 20 70 CFIDHN CN(CCN1CCCC1)C(=O)C1CCC(C)(C)CC1 ZINC000159989381 322331636 /nfs/dbraw/zinc/33/16/36/322331636.db2.gz HNSMTUUFBOGBNO-UHFFFAOYSA-N 0 3 266.429 2.757 20 70 CFIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1c(C)nn(C)c1C ZINC000160560858 322339768 /nfs/dbraw/zinc/33/97/68/322339768.db2.gz HFWFKTLXRUAPQC-RISCZKNCSA-N 0 3 294.443 2.732 20 70 CFIDHN Cc1nccc(N(CCN(C)C)CC2CCCCC2)n1 ZINC000160936672 322345516 /nfs/dbraw/zinc/34/55/16/322345516.db2.gz LQTHZFXWXDIJTG-UHFFFAOYSA-N 0 3 276.428 2.733 20 70 CFIDHN C[C@@H](NCCc1ccc2c(c1)OCO2)c1cncs1 ZINC000161123449 322347692 /nfs/dbraw/zinc/34/76/92/322347692.db2.gz GTGMTPCFFZKMTK-SNVBAGLBSA-N 0 3 276.361 2.765 20 70 CFIDHN Brc1cncc(CNC[C@H]2CCCS2)c1 ZINC000160589213 518231470 /nfs/dbraw/zinc/23/14/70/518231470.db2.gz GHOSFXCHXRUZDF-LLVKDONJSA-N 0 3 287.226 2.829 20 70 CFIDHN CCCN1CCCN(C(=O)CC2CCCCC2)CC1 ZINC000160389856 519848791 /nfs/dbraw/zinc/84/87/91/519848791.db2.gz YCEJKCVGFPXOTC-UHFFFAOYSA-N 0 3 266.429 2.901 20 70 CFIDHN CCCN1CCCN(C(=O)[C@H](C)c2cccs2)CC1 ZINC000159930297 519850442 /nfs/dbraw/zinc/85/04/42/519850442.db2.gz OZNZFQVCWYJSGS-CYBMUJFWSA-N 0 3 280.437 2.796 20 70 CFIDHN CCOC[C@H]1CCCN(Cc2c(C)nc3ccccn32)C1 ZINC000160411405 520172318 /nfs/dbraw/zinc/17/23/18/520172318.db2.gz PTBDYJRBNISSFR-HNNXBMFYSA-N 0 3 287.407 2.891 20 70 CFIDHN CCO[C@H]1C[C@H](NCc2cnn3ccccc23)C1(C)C ZINC000217871541 520577786 /nfs/dbraw/zinc/57/77/86/520577786.db2.gz GGKBAJIKXNLARV-GJZGRUSLSA-N 0 3 273.380 2.628 20 70 CFIDHN CC[C@H](NCCOCC(F)(F)F)c1c(C)nn(C)c1C ZINC000159375587 522594524 /nfs/dbraw/zinc/59/45/24/522594524.db2.gz QTTQDJQQFRSSCU-NSHDSACASA-N 0 3 293.333 2.657 20 70 CFIDHN CC[C@H](C)N(C)CCNC(=O)Nc1cccc(C(C)=O)c1 ZINC000217401546 523918354 /nfs/dbraw/zinc/91/83/54/523918354.db2.gz YXEATTWGVWMXNQ-LBPRGKRZSA-N 0 3 291.395 2.741 20 70 CFIDHN Cc1cccc([C@H](C)C(=O)NCCN2CCCCC2)c1 ZINC000159892145 524861049 /nfs/dbraw/zinc/86/10/49/524861049.db2.gz YPIYWGQUKVDMAJ-HNNXBMFYSA-N 0 3 274.408 2.701 20 70 CFIDHN C[C@@H]1C[C@H](N(C)c2nc(C(C)(C)C)ns2)CCN1C ZINC000159624261 525419670 /nfs/dbraw/zinc/41/96/70/525419670.db2.gz MHUHMTQUFZENDL-GHMZBOCLSA-N 0 3 282.457 2.755 20 70 CFIDHN c1ccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 ZINC000161407404 526468501 /nfs/dbraw/zinc/46/85/01/526468501.db2.gz HCBYBWIRPKPORN-OAHLLOKOSA-N 0 3 282.391 2.604 20 70 CFIDHN CC(C)N(CCOCC1CC1)CCc1nccs1 ZINC000159855779 528910295 /nfs/dbraw/zinc/91/02/95/528910295.db2.gz ITGOMJIIRBENSJ-UHFFFAOYSA-N 0 3 268.426 2.823 20 70 CFIDHN CCC(C)(C)NC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159618353 348013347 /nfs/dbraw/zinc/01/33/47/348013347.db2.gz XMPHWCKZBLQINZ-STQMWFEESA-N 0 3 252.402 2.556 20 70 CFIDHN C[C@@H]1Cc2ccccc2N1C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000160665090 348019660 /nfs/dbraw/zinc/01/96/60/348019660.db2.gz GFEJOBGQNPVTCM-CJNGLKHVSA-N 0 3 299.418 2.632 20 70 CFIDHN C[C@H]1Cc2ccccc2N1C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160664956 348019691 /nfs/dbraw/zinc/01/96/91/348019691.db2.gz GFEJOBGQNPVTCM-XJKSGUPXSA-N 0 3 299.418 2.632 20 70 CFIDHN Cc1cccc2c1CCN2C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160755555 348020503 /nfs/dbraw/zinc/02/05/03/348020503.db2.gz YYZYVCKCUJYBRA-OAHLLOKOSA-N 0 3 299.418 2.551 20 70 CFIDHN CCO[C@@H]1C[C@@H](NCc2nn(C)c3ccccc23)C1(C)C ZINC000217879684 348165884 /nfs/dbraw/zinc/16/58/84/348165884.db2.gz CKQVJJGGWWUJBC-HZPDHXFCSA-N 0 3 287.407 2.867 20 70 CFIDHN CCCN(CCCCS(C)(=O)=O)Cc1ccccc1 ZINC000161135400 539830531 /nfs/dbraw/zinc/83/05/31/539830531.db2.gz RSISVSDAHOCUSV-UHFFFAOYSA-N 0 3 283.437 2.723 20 70 CFIDHN COC(C)(C)C[C@H](C)NC(=O)[C@H](C)[C@H](N)c1ccccc1 ZINC000160966548 188500652 /nfs/dbraw/zinc/50/06/52/188500652.db2.gz KPFSLHDREJERLQ-GUTXKFCHSA-N 0 3 292.423 2.642 20 70 CFIDHN Cc1nccc(NC(=O)NCCN2CCCCC2)c1Cl ZINC000159703074 541008192 /nfs/dbraw/zinc/00/81/92/541008192.db2.gz WLLGHFAZHJMCCC-UHFFFAOYSA-N 0 3 296.802 2.651 20 70 CFIDHN CCCC(=O)Nc1cccc(CN[C@@H](COC)C2CC2)c1 ZINC000159944106 541018769 /nfs/dbraw/zinc/01/87/69/541018769.db2.gz PMNASOWUKKKWDO-INIZCTEOSA-N 0 3 290.407 2.940 20 70 CFIDHN COc1ccc([C@@H](C)N(C)CCCCS(C)(=O)=O)cc1 ZINC000161335170 541590616 /nfs/dbraw/zinc/59/06/16/541590616.db2.gz GUTJGSOEYBCQMT-CYBMUJFWSA-N 0 3 299.436 2.513 20 70 CFIDHN CCCN(C)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000159903919 378737206 /nfs/dbraw/zinc/73/72/06/378737206.db2.gz CHERWLBMVPFNNH-HOCLYGCPSA-N 0 3 289.423 2.701 20 70 CFIDHN CC(C)(N)C(=O)NCC(C)(C)c1ccc(F)cc1Cl ZINC000160042131 378745415 /nfs/dbraw/zinc/74/54/15/378745415.db2.gz OPZVEKOQSWWPHP-UHFFFAOYSA-N 0 3 286.778 2.610 20 70 CFIDHN CN(CCOc1cccc(Cl)c1)CCn1ccnc1 ZINC000159689961 378724463 /nfs/dbraw/zinc/72/44/63/378724463.db2.gz TUKPHIUZFHFEDV-UHFFFAOYSA-N 0 3 279.771 2.547 20 70 CFIDHN COc1cc([C@H](C)NCCO)ccc1SC(F)F ZINC000159713972 378725827 /nfs/dbraw/zinc/72/58/27/378725827.db2.gz SKIVCAJPORCNBP-QMMMGPOBSA-N 0 3 277.336 2.653 20 70 CFIDHN Cc1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCCC2)c(C)c1 ZINC000159728743 378727325 /nfs/dbraw/zinc/72/73/25/378727325.db2.gz GREHKWPMUCTKOT-CABCVRRESA-N 0 3 274.408 2.965 20 70 CFIDHN Cc1ccc([C@@H](C)N[C@H](C)C(=O)N2CCCC2)c(C)c1 ZINC000159729000 378727340 /nfs/dbraw/zinc/72/73/40/378727340.db2.gz GREHKWPMUCTKOT-HUUCEWRRSA-N 0 3 274.408 2.965 20 70 CFIDHN CC[C@@H](NC(=O)[C@@H]1CCCCN1)c1ccc(F)cc1F ZINC000159728319 378727894 /nfs/dbraw/zinc/72/78/94/378727894.db2.gz MLORBGCQOHISPZ-KGLIPLIRSA-N 0 3 282.334 2.674 20 70 CFIDHN C[C@@H](NC[C@H](C)N1CCc2ccccc2C1)c1cnn(C)c1 ZINC000159809237 378731791 /nfs/dbraw/zinc/73/17/91/378731791.db2.gz DWCYNWDWOZWLKH-LSDHHAIUSA-N 0 3 298.434 2.518 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](CC(C)C)c1ccccn1)CC2 ZINC000160323739 378763452 /nfs/dbraw/zinc/76/34/52/378763452.db2.gz YWJSOMDVLDJQSG-ZBFHGGJFSA-N 0 3 299.422 2.673 20 70 CFIDHN CC1(C)C[C@H](NCc2cccnc2Cl)CCO1 ZINC000160440165 378772721 /nfs/dbraw/zinc/77/27/21/378772721.db2.gz YSKVRXXAUZJNNK-LLVKDONJSA-N 0 3 254.761 2.782 20 70 CFIDHN Cc1ccsc1C(=O)NC[C@H]1CCCN1CC(C)C ZINC000160456128 378773881 /nfs/dbraw/zinc/77/38/81/378773881.db2.gz KCQIDMIBYOUEEK-CYBMUJFWSA-N 0 3 280.437 2.907 20 70 CFIDHN COc1cccc(CN[C@H]2CCOC(C)(C)C2)c1OC ZINC000160470289 378774835 /nfs/dbraw/zinc/77/48/35/378774835.db2.gz WKUDQKNEACIJTL-ZDUSSCGKSA-N 0 3 279.380 2.751 20 70 CFIDHN Cc1cccc([C@@H](C)NCC(=O)NCC(F)(F)F)c1C ZINC000160536352 378778518 /nfs/dbraw/zinc/77/85/18/378778518.db2.gz KQEBZLZFXUCZBL-LLVKDONJSA-N 0 3 288.313 2.633 20 70 CFIDHN CSCCCNCc1cncc(Br)c1 ZINC000160577916 378782206 /nfs/dbraw/zinc/78/22/06/378782206.db2.gz LTGAMIGBXNWHKY-UHFFFAOYSA-N 0 3 275.215 2.687 20 70 CFIDHN CCc1nnc(CN[C@@H](C)[C@H](C)c2ccccc2)[nH]1 ZINC000160563559 378782828 /nfs/dbraw/zinc/78/28/28/378782828.db2.gz BICDJGAHAHBNRZ-RYUDHWBXSA-N 0 3 258.369 2.649 20 70 CFIDHN CCc1nnc(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)[n-]1 ZINC000160563559 378782833 /nfs/dbraw/zinc/78/28/33/378782833.db2.gz BICDJGAHAHBNRZ-RYUDHWBXSA-N 0 3 258.369 2.649 20 70 CFIDHN C[C@H]1CCC[C@H](C(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000160578553 378784205 /nfs/dbraw/zinc/78/42/05/378784205.db2.gz PYJCCNULNVXIDJ-KKUMJFAQSA-N 0 3 266.429 2.803 20 70 CFIDHN Cc1cc2c(cc1C)[C@H](NCC(C)(C)O)CCCO2 ZINC000160623699 378786401 /nfs/dbraw/zinc/78/64/01/378786401.db2.gz SZHYYTOXVDLKIU-CQSZACIVSA-N 0 3 263.381 2.878 20 70 CFIDHN CC(C)[C@@H](NC(=O)[C@@H](C)N)c1ccccc1Cl ZINC000160829636 378801518 /nfs/dbraw/zinc/80/15/18/378801518.db2.gz VHLDHUPSFIXELI-BXKDBHETSA-N 0 3 254.761 2.501 20 70 CFIDHN Cc1noc(C)c1[C@@H](C)CC(=O)N(CCN(C)C)C(C)C ZINC000161182848 378829017 /nfs/dbraw/zinc/82/90/17/378829017.db2.gz GRYKUPKWOBMYOD-LBPRGKRZSA-N 0 3 295.427 2.584 20 70 CFIDHN C[C@H](N[C@H]1CCO[C@@]2(CCSC2)C1)c1ccccn1 ZINC000160850710 378804263 /nfs/dbraw/zinc/80/42/63/378804263.db2.gz DCOJBECXWZAPEF-YDHLFZDLSA-N 0 3 278.421 2.787 20 70 CFIDHN Cc1nccc(N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)n1 ZINC000160867589 378805347 /nfs/dbraw/zinc/80/53/47/378805347.db2.gz RNZKLYKKNXOYIK-CZUORRHYSA-N 0 3 282.391 2.860 20 70 CFIDHN CC[C@H](N[C@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1 ZINC000160928666 378809636 /nfs/dbraw/zinc/80/96/36/378809636.db2.gz YPAJHDWTYKZUIT-GJZGRUSLSA-N 0 3 278.371 2.876 20 70 CFIDHN CC[C@H](N[C@@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1 ZINC000160928413 378810302 /nfs/dbraw/zinc/81/03/02/378810302.db2.gz YPAJHDWTYKZUIT-LSDHHAIUSA-N 0 3 278.371 2.876 20 70 CFIDHN O=C(CCNCc1cc(F)cc(Cl)c1)N1CCCCC1 ZINC000160982509 378813312 /nfs/dbraw/zinc/81/33/12/378813312.db2.gz VYGAINXGQQNZRE-UHFFFAOYSA-N 0 3 298.789 2.971 20 70 CFIDHN CC(C)(N)C(=O)Nc1cc(C2CCCCCC2)[nH]n1 ZINC000161070952 378819289 /nfs/dbraw/zinc/81/92/89/378819289.db2.gz JCISEDDDRGOBQR-UHFFFAOYSA-N 0 3 264.373 2.523 20 70 CFIDHN CCN(C(=O)CN)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000161115569 378822905 /nfs/dbraw/zinc/82/29/05/378822905.db2.gz ZTOZXZQGOZDUDJ-SECBINFHSA-N 0 3 274.286 2.574 20 70 CFIDHN Cc1ccc([C@@H](C)CNC(=O)[C@@H](N)Cc2ccccc2)cc1 ZINC000161168579 378828065 /nfs/dbraw/zinc/82/80/65/378828065.db2.gz WGDSCPBOEDAWAX-YJBOKZPZSA-N 0 3 296.414 2.785 20 70 CFIDHN Cc1ncc([C@@H](C)NC[C@@H](CO)c2ccccc2)c(C)n1 ZINC000161469566 378849514 /nfs/dbraw/zinc/84/95/14/378849514.db2.gz KVGFVHFLAOLTLI-WBMJQRKESA-N 0 3 285.391 2.520 20 70 CFIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)N1CCCCC1 ZINC000160585548 322340039 /nfs/dbraw/zinc/34/00/39/322340039.db2.gz VDJUWNDEOKWSBA-KBPBESRZSA-N 0 3 254.418 2.755 20 70 CFIDHN CS[C@@H](C)CC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000160718405 322341566 /nfs/dbraw/zinc/34/15/66/322341566.db2.gz XDHMKKXIZKPOFJ-ZDUSSCGKSA-N 0 3 286.485 2.708 20 70 CFIDHN C[C@H](NCc1cccc2cc[nH]c21)C(=O)NC(C)(C)C ZINC000218157501 382789294 /nfs/dbraw/zinc/78/92/94/382789294.db2.gz FLTLOLIMMWSREN-NSHDSACASA-N 0 3 273.380 2.561 20 70 CFIDHN Cc1nc(CCNCc2nn(C)c3ccccc23)cs1 ZINC000218099151 382789582 /nfs/dbraw/zinc/78/95/82/382789582.db2.gz HKIZDORZQFQRGP-UHFFFAOYSA-N 0 3 286.404 2.671 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H]2CCCCC2(C)C)CC1 ZINC000159976498 285214982 /nfs/dbraw/zinc/21/49/82/285214982.db2.gz DMQHMHFEEFLPBS-AWEZNQCLSA-N 0 3 281.444 2.692 20 70 CFIDHN Cc1ccc(OCCN(C)C[C@H](O)Cc2ccccc2)cc1 ZINC000218763353 393758413 /nfs/dbraw/zinc/75/84/13/393758413.db2.gz YFDPYQCUICPBTQ-GOSISDBHSA-N 0 3 299.414 2.909 20 70 CFIDHN C[C@H](N)C(=O)N[C@@H](CC1CCCCC1)C(C)(C)C ZINC000160073237 394366039 /nfs/dbraw/zinc/36/60/39/394366039.db2.gz BFMGYLUCCGFUCA-AAEUAGOBSA-N 0 3 254.418 2.835 20 70 CFIDHN O=C(CCNCc1cccc2cc[nH]c21)N1CCCCC1 ZINC000218116771 397620558 /nfs/dbraw/zinc/62/05/58/397620558.db2.gz OSZLLQVTPQDYMK-UHFFFAOYSA-N 0 3 285.391 2.660 20 70 CFIDHN C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)[C@@H](N)C(C)(C)C ZINC000159802974 280016299 /nfs/dbraw/zinc/01/62/99/280016299.db2.gz FRONBGOBJUXJHC-CORIIIEPSA-N 0 3 292.398 2.904 20 70 CFIDHN CSC[C@H](CCO)N[C@@H]1CCCOc2ccc(C)cc21 ZINC000160275593 295623275 /nfs/dbraw/zinc/62/32/75/295623275.db2.gz JDKKXKGZPVVZEI-DZGCQCFKSA-N 0 3 295.448 2.912 20 70 CFIDHN CCC(CC)(CNCc1cccc(F)c1)C(=O)OC ZINC000159657385 322326417 /nfs/dbraw/zinc/32/64/17/322326417.db2.gz AIGCIRFYVGKOPE-UHFFFAOYSA-N 0 3 267.344 2.895 20 70 CFIDHN Cc1cc(C)c(C(=O)NCCCN(C)Cc2ccccc2)[nH]1 ZINC000159693438 322326694 /nfs/dbraw/zinc/32/66/94/322326694.db2.gz ZCCNBOVPIRRMTQ-UHFFFAOYSA-N 0 3 299.418 2.883 20 70 CFIDHN Cc1c([C@@H](C)NCC(C)(C)O)cnn1-c1ccc(F)cc1 ZINC000160607790 322340697 /nfs/dbraw/zinc/34/06/97/322340697.db2.gz RJAPSFGWLXHJGU-LLVKDONJSA-N 0 3 291.370 2.741 20 70 CFIDHN Cc1nc2ccccn2c1CN1C[C@H](C)S[C@@H](C)C1 ZINC000160815384 322343644 /nfs/dbraw/zinc/34/36/44/322343644.db2.gz NNZBKZKAGJBPPE-RYUDHWBXSA-N 0 3 275.421 2.969 20 70 CFIDHN C[C@@H](NCCc1ccc2c(c1)OCO2)c1cncc(F)c1 ZINC000161140519 322348295 /nfs/dbraw/zinc/34/82/95/322348295.db2.gz CVCLURJXPADEJE-LLVKDONJSA-N 0 3 288.322 2.843 20 70 CFIDHN CCCN(CCO)Cc1cccc(OC(F)(F)F)c1 ZINC000161229266 322349181 /nfs/dbraw/zinc/34/91/81/322349181.db2.gz UATZOQRCGRFAJZ-UHFFFAOYSA-N 0 3 277.286 2.790 20 70 CFIDHN Cc1ccsc1CCCC(=O)NC1CCN(C)CC1 ZINC000159854328 534460078 /nfs/dbraw/zinc/46/00/78/534460078.db2.gz HHDPVGRNQFODFP-UHFFFAOYSA-N 0 3 280.437 2.590 20 70 CFIDHN CC1(C)C[C@@H](NCC[S@](=O)c2ccccc2)C(C)(C)O1 ZINC000160788015 520524585 /nfs/dbraw/zinc/52/45/85/520524585.db2.gz JALFFFIYLOPXHO-JLTOFOAXSA-N 0 3 295.448 2.730 20 70 CFIDHN CO[C@]1(C)C[C@@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160899177 521754613 /nfs/dbraw/zinc/75/46/13/521754613.db2.gz GRVSLKZOXLOPRS-RHSMWYFYSA-N 0 3 287.407 2.970 20 70 CFIDHN CC[C@H](NC(=O)N1CCCN(CC)CC1)c1cccs1 ZINC000159722086 522419429 /nfs/dbraw/zinc/41/94/29/522419429.db2.gz FPHLMIAGAMKWMJ-ZDUSSCGKSA-N 0 3 295.452 2.936 20 70 CFIDHN COc1cc(CNC(C)(C)[C@@H](C)O)cc(Cl)c1OC ZINC000161122557 522439532 /nfs/dbraw/zinc/43/95/32/522439532.db2.gz LZVBKHPIWQOKHI-SECBINFHSA-N 0 3 287.787 2.606 20 70 CFIDHN COC[C@@H]1CCCN(Cc2c(C)nc3ccccn32)C1 ZINC000160394507 522457285 /nfs/dbraw/zinc/45/72/85/522457285.db2.gz AJLRPFAGACNAQJ-CQSZACIVSA-N 0 3 273.380 2.501 20 70 CFIDHN CC[C@@H](O)CCNCc1cccc(OC(F)(F)F)c1 ZINC000217872199 522987487 /nfs/dbraw/zinc/98/74/87/522987487.db2.gz GZMGUDVATZLZBL-LLVKDONJSA-N 0 3 277.286 2.836 20 70 CFIDHN CCn1cc([C@H](C)NC[C@@H]2CC(=O)Nc3ccccc32)cn1 ZINC000160645448 523473523 /nfs/dbraw/zinc/47/35/23/523473523.db2.gz GEYKXRFYRQYNKH-STQMWFEESA-N 0 3 298.390 2.680 20 70 CFIDHN CCc1ccc(CC(=O)N[C@@H](C)CN2CCCCC2)cc1 ZINC000160360271 523909433 /nfs/dbraw/zinc/90/94/33/523909433.db2.gz QQUJZJLHBZHNRV-HNNXBMFYSA-N 0 3 288.435 2.782 20 70 CFIDHN C[C@@H]1CCC[C@H](C(=O)NCCN2CCCC[C@@H]2C)C1 ZINC000160578442 524346651 /nfs/dbraw/zinc/34/66/51/524346651.db2.gz PYJCCNULNVXIDJ-ILXRZTDVSA-N 0 3 266.429 2.803 20 70 CFIDHN C[C@H]1CC[C@H](C(N)=O)CN1Cc1cnc(C(C)(C)C)s1 ZINC000159645784 524391607 /nfs/dbraw/zinc/39/16/07/524391607.db2.gz ILNOCXCICGYIEH-QWRGUYRKSA-N 0 3 295.452 2.526 20 70 CFIDHN C[C@@H]1CN(Cc2ccc(OC(F)(F)F)cc2)CC[C@@H]1O ZINC000159438447 524995796 /nfs/dbraw/zinc/99/57/96/524995796.db2.gz GQQWCNQBVWKMLG-MFKMUULPSA-N 0 3 289.297 2.788 20 70 CFIDHN C[C@@H]1CN2CCC[C@@H]2CN1c1nc(C(C)(C)C)ns1 ZINC000159474881 525085100 /nfs/dbraw/zinc/08/51/00/525085100.db2.gz DMIXABLNBZWOHH-GHMZBOCLSA-N 0 3 280.441 2.509 20 70 CFIDHN CSC[C@@H](CCO)N[C@@H](CC(C)C)c1ccccn1 ZINC000160174590 525641682 /nfs/dbraw/zinc/64/16/82/525641682.db2.gz FNIWMZPUYDTAGX-HIFRSBDPSA-N 0 3 282.453 2.872 20 70 CFIDHN FC(F)(F)COCCNCc1cccc2cc[nH]c21 ZINC000218150845 527670895 /nfs/dbraw/zinc/67/08/95/527670895.db2.gz WHHXVFVMKRVNPA-UHFFFAOYSA-N 0 3 272.270 2.836 20 70 CFIDHN FC(F)(F)OCCNCc1cccc2cccnc21 ZINC000159426322 527674343 /nfs/dbraw/zinc/67/43/43/527674343.db2.gz OVOVTQBZCJZETG-UHFFFAOYSA-N 0 3 270.254 2.861 20 70 CFIDHN CCN1CCC(NC(=O)CCCc2sccc2C)CC1 ZINC000159911667 528977731 /nfs/dbraw/zinc/97/77/31/528977731.db2.gz UEWJMWYRECHPHN-UHFFFAOYSA-N 0 3 294.464 2.980 20 70 CFIDHN CCN1CCCN(C(=O)NCCCCC(C)(C)C)CC1 ZINC000159822212 529022857 /nfs/dbraw/zinc/02/28/57/529022857.db2.gz LGCFXUUIGUKNGC-UHFFFAOYSA-N 0 3 283.460 2.940 20 70 CFIDHN CCN1CCCN(C(=O)NCCCC2CCCC2)CC1 ZINC000159646368 529023152 /nfs/dbraw/zinc/02/31/52/529023152.db2.gz QMPIMAYQYLYUFQ-UHFFFAOYSA-N 0 3 281.444 2.694 20 70 CFIDHN CCN1CCCC[C@H]1CNC(=O)C[C@@H](C)c1ccncc1 ZINC000160251911 545515259 /nfs/dbraw/zinc/51/52/59/545515259.db2.gz VBXGYGUEBPYLRO-ZBFHGGJFSA-N 0 3 289.423 2.566 20 70 CFIDHN CCN(C(=O)N[C@@H]1CCN(CC2CC2)C1)C1CCCCC1 ZINC000160641278 348019576 /nfs/dbraw/zinc/01/95/76/348019576.db2.gz TWESKKCYLQXWFF-OAHLLOKOSA-N 0 3 293.455 2.835 20 70 CFIDHN C[C@H]1Cc2ccccc2N1C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000160665224 348019733 /nfs/dbraw/zinc/01/97/33/348019733.db2.gz GFEJOBGQNPVTCM-BBRMVZONSA-N 0 3 299.418 2.632 20 70 CFIDHN COCCCCCNCc1cnc2ccccc2n1 ZINC000218240530 348166711 /nfs/dbraw/zinc/16/67/11/348166711.db2.gz DJMIUJBLCAFHGX-UHFFFAOYSA-N 0 3 259.353 2.536 20 70 CFIDHN CCn1nccc1CNCCc1cccc(Cl)c1 ZINC000159890917 541015740 /nfs/dbraw/zinc/01/57/40/541015740.db2.gz LMHNEVCGNUUEKC-UHFFFAOYSA-N 0 3 263.772 2.889 20 70 CFIDHN C[C@@H](c1ccccc1)N1CCN(c2ccncc2)CC1 ZINC000161353318 541600905 /nfs/dbraw/zinc/60/09/05/541600905.db2.gz JZYBEMTTZPUUAC-HNNXBMFYSA-N 0 3 267.376 2.965 20 70 CFIDHN Cc1ccc([C@@H](C)N(C)CCCCS(C)(=O)=O)cc1 ZINC000161467120 541647519 /nfs/dbraw/zinc/64/75/19/541647519.db2.gz REHXSLGYAMRCHE-CQSZACIVSA-N 0 3 283.437 2.813 20 70 CFIDHN CCN(CC)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000159848483 378734575 /nfs/dbraw/zinc/73/45/75/378734575.db2.gz MMDAROKOPLTGSQ-HOCLYGCPSA-N 0 3 289.423 2.701 20 70 CFIDHN C[C@@H](NC[C@@](C)(O)c1ccsc1)c1cncs1 ZINC000159959669 378741009 /nfs/dbraw/zinc/74/10/09/378741009.db2.gz GJSJPTUFXCHILP-BXKDBHETSA-N 0 3 268.407 2.763 20 70 CFIDHN CCOC[C@@H]1CCN(CCC(=O)c2ccc(C)cc2)C1 ZINC000159987527 378742406 /nfs/dbraw/zinc/74/24/06/378742406.db2.gz DVMVMYSQRYUPIQ-OAHLLOKOSA-N 0 3 275.392 2.926 20 70 CFIDHN Cc1ccc(C(=O)CCN(C)C[C@H]2CCOC2)cc1 ZINC000160026444 378744071 /nfs/dbraw/zinc/74/40/71/378744071.db2.gz BRGLELLQJAPUCA-CQSZACIVSA-N 0 3 261.365 2.536 20 70 CFIDHN CC[C@H](N)C(=O)NCC(C)(C)c1ccc(F)cc1Cl ZINC000160042827 378745474 /nfs/dbraw/zinc/74/54/74/378745474.db2.gz HCKVQKINEADLGN-LBPRGKRZSA-N 0 3 286.778 2.610 20 70 CFIDHN CC[C@H](N)C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 ZINC000159528790 378715144 /nfs/dbraw/zinc/71/51/44/378715144.db2.gz QSVJOSGIAHRJNL-LBPRGKRZSA-N 0 3 291.395 2.655 20 70 CFIDHN Clc1ccc(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)cn1 ZINC000159649549 378722809 /nfs/dbraw/zinc/72/28/09/378722809.db2.gz XNIGWSPBNSIARK-XBFCOCLRSA-N 0 3 278.783 2.782 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000159716567 378726367 /nfs/dbraw/zinc/72/63/67/378726367.db2.gz LDNIMBRCQPPYDU-QLFBSQMISA-N 0 3 292.448 2.519 20 70 CFIDHN Cc1ccc([C@H]2CSCCN2CCn2ccnc2)cc1 ZINC000159832254 378733492 /nfs/dbraw/zinc/73/34/92/378733492.db2.gz AGJBAPVJCXJNGM-MRXNPFEDSA-N 0 3 287.432 2.982 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc3c(c1)CCC3)CC2 ZINC000160383006 378767959 /nfs/dbraw/zinc/76/79/59/378767959.db2.gz YKLMBOJYXHFYOI-YVEFUNNKSA-N 0 3 296.418 2.741 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc3c(c1)CCC3)CC2 ZINC000160383238 378768682 /nfs/dbraw/zinc/76/86/82/378768682.db2.gz YKLMBOJYXHFYOI-SJKOYZFVSA-N 0 3 296.418 2.741 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(C)c(C)c1)CC2 ZINC000160414082 378770551 /nfs/dbraw/zinc/77/05/51/378770551.db2.gz XURVSWYOEZYOHA-CZUORRHYSA-N 0 3 284.407 2.869 20 70 CFIDHN CC(C)CN1CCC[C@@H]1CNC(=O)c1cccs1 ZINC000160427905 378771667 /nfs/dbraw/zinc/77/16/67/378771667.db2.gz NINDTEBQOJTXML-GFCCVEGCSA-N 0 3 266.410 2.598 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cc3ccccc3o1)CC2 ZINC000160551401 378781271 /nfs/dbraw/zinc/78/12/71/378781271.db2.gz RCLIFPCFYGOKSR-RISCZKNCSA-N 0 3 296.374 2.998 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cc3ccccc3o1)CC2 ZINC000160551148 378781392 /nfs/dbraw/zinc/78/13/92/378781392.db2.gz RCLIFPCFYGOKSR-FZMZJTMJSA-N 0 3 296.374 2.998 20 70 CFIDHN COc1ccc(CN(CC(OC)OC)[C@@H](C)C2CC2)cc1 ZINC000160669079 378789941 /nfs/dbraw/zinc/78/99/41/378789941.db2.gz TYFMAJJJTOVDIT-ZDUSSCGKSA-N 0 3 293.407 2.915 20 70 CFIDHN CCCn1ccc2ccc(NC(=O)C(C)(C)N)cc21 ZINC000161281278 378836118 /nfs/dbraw/zinc/83/61/18/378836118.db2.gz TWDHPPKPTHZNDX-UHFFFAOYSA-N 0 3 259.353 2.727 20 70 CFIDHN CCCN(CCO)Cc1cc2cc(OC)ccc2o1 ZINC000161236388 378833040 /nfs/dbraw/zinc/83/30/40/378833040.db2.gz AFEIZOMAGIWDOR-UHFFFAOYSA-N 0 3 263.337 2.646 20 70 CFIDHN C[C@H](N[C@@H]1CCO[C@@]2(CCSC2)C1)c1ccccn1 ZINC000160850583 378804076 /nfs/dbraw/zinc/80/40/76/378804076.db2.gz DCOJBECXWZAPEF-GUTXKFCHSA-N 0 3 278.421 2.787 20 70 CFIDHN Cc1nccc(N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)n1 ZINC000160867468 378805695 /nfs/dbraw/zinc/80/56/95/378805695.db2.gz RNZKLYKKNXOYIK-BBRMVZONSA-N 0 3 282.391 2.860 20 70 CFIDHN CC[C@H](C)NC(=O)CCNCc1cc(F)cc(Cl)c1 ZINC000160905227 378807219 /nfs/dbraw/zinc/80/72/19/378807219.db2.gz NZZFNNYPEBUBCX-JTQLQIEISA-N 0 3 286.778 2.874 20 70 CFIDHN COC(CN1C[C@H](C)C[C@H]1c1cccc(F)c1)OC ZINC000161271380 378835614 /nfs/dbraw/zinc/83/56/14/378835614.db2.gz LRHPOJPLFVQBHN-RISCZKNCSA-N 0 3 267.344 2.828 20 70 CFIDHN CCN(C(=O)[C@H](C)N)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000161115354 378823238 /nfs/dbraw/zinc/82/32/38/378823238.db2.gz GNTHBRXZKWXSPI-VHSXEESVSA-N 0 3 288.313 2.962 20 70 CFIDHN C[C@H](N)C(=O)Nc1cccc(Cl)c1SCC(F)F ZINC000161129080 378824959 /nfs/dbraw/zinc/82/49/59/378824959.db2.gz GLWBPHARGNOLOA-LURJTMIESA-N 0 3 294.754 2.983 20 70 CFIDHN C[C@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)C(C)(C)C ZINC000161421245 378846473 /nfs/dbraw/zinc/84/64/73/378846473.db2.gz POXOXIYPCFAEPZ-NWANDNLSSA-N 0 3 274.408 2.764 20 70 CFIDHN C[C@@H](NC[C@@H](CO)c1ccccc1)c1cncs1 ZINC000161467655 378848864 /nfs/dbraw/zinc/84/88/64/378848864.db2.gz NWTHJCJIAKLFLN-YPMHNXCESA-N 0 3 262.378 2.570 20 70 CFIDHN CCOC(=O)[C@@H]1CC[C@H](NCc2ccco2)C[C@@H]1C ZINC000161480923 378849426 /nfs/dbraw/zinc/84/94/26/378849426.db2.gz SOFMJNFLZMULJW-SGMGOOAPSA-N 0 3 265.353 2.737 20 70 CFIDHN CN(C[C@@H](O)c1cc2ccccc2o1)C[C@@H]1CCCO1 ZINC000216963674 382785391 /nfs/dbraw/zinc/78/53/91/382785391.db2.gz GXBSCAFWCKUTMQ-UONOGXRCSA-N 0 3 275.348 2.577 20 70 CFIDHN CN1CCC[C@H]1CNCc1nc(-c2ccccc2)cs1 ZINC000218235912 382789950 /nfs/dbraw/zinc/78/99/50/382789950.db2.gz FFYAVBPYSGCKLN-AWEZNQCLSA-N 0 3 287.432 2.994 20 70 CFIDHN C[C@@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccccc1 ZINC000218460968 382790345 /nfs/dbraw/zinc/79/03/45/382790345.db2.gz HKPUMDHSXFAMIP-HIFRSBDPSA-N 0 3 281.421 2.629 20 70 CFIDHN COc1ccc2c(c1)[C@@H](N[C@H](C)[C@@H]1CCCO1)CCO2 ZINC000217966613 393757761 /nfs/dbraw/zinc/75/77/61/393757761.db2.gz LPEBRBWGYRPVPL-UGFHNGPFSA-N 0 3 277.364 2.676 20 70 CFIDHN Cc1ccccc1OCCN(C)C[C@@H](O)Cc1ccccc1 ZINC000218763723 393758258 /nfs/dbraw/zinc/75/82/58/393758258.db2.gz BGEHAYUHZQALNM-SFHVURJKSA-N 0 3 299.414 2.909 20 70 CFIDHN Cc1ccccc1OCCN(C)C[C@H](O)Cc1ccccc1 ZINC000218763739 393758282 /nfs/dbraw/zinc/75/82/82/393758282.db2.gz BGEHAYUHZQALNM-GOSISDBHSA-N 0 3 299.414 2.909 20 70 CFIDHN CC(C)(N)C(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000160080895 394366024 /nfs/dbraw/zinc/36/60/24/394366024.db2.gz ODNYLAXOVFNWIR-JTQLQIEISA-N 0 3 287.190 2.834 20 70 CFIDHN CSC[C@@H](CCO)N[C@@H]1CCc2cc(F)ccc21 ZINC000160153574 394366072 /nfs/dbraw/zinc/36/60/72/394366072.db2.gz NUJQIVGMGSUYQN-TZMCWYRMSA-N 0 3 269.385 2.517 20 70 CFIDHN Cc1cc(N2CCC(n3ccnn3)CC2)c2ccccc2n1 ZINC000160214865 394366087 /nfs/dbraw/zinc/36/60/87/394366087.db2.gz SMUMKYUDALJVDH-UHFFFAOYSA-N 0 3 293.374 2.976 20 70 CFIDHN Cc1c(NC(=O)[C@@]2(F)CCNC2)sc2c1CCCC2 ZINC000160989231 394366862 /nfs/dbraw/zinc/36/68/62/394366862.db2.gz RMWBSRRWUSNBRL-CQSZACIVSA-N 0 3 282.384 2.575 20 70 CFIDHN CCO[C@H]1C[C@@H](NC(=O)[C@@H](N)CC(C)C)C12CCCCC2 ZINC000161182981 286483813 /nfs/dbraw/zinc/48/38/13/286483813.db2.gz DINMGSCHLDJQLY-ZNMIVQPWSA-N 0 3 296.455 2.604 20 70 CFIDHN Cc1cc2c(cc1C)[C@@H](NCC(C)(C)O)CCCO2 ZINC000160623593 301443201 /nfs/dbraw/zinc/44/32/01/301443201.db2.gz SZHYYTOXVDLKIU-AWEZNQCLSA-N 0 3 263.381 2.878 20 70 CFIDHN CC(C)C[C@H](C)NC(=O)N[C@@H](C)CN1CCCCC1 ZINC000159611203 322324997 /nfs/dbraw/zinc/32/49/97/322324997.db2.gz PFVPNUFTEFNBRW-KBPBESRZSA-N 0 3 269.433 2.595 20 70 CFIDHN Cc1cc(C)c(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)[nH]1 ZINC000159634557 322325701 /nfs/dbraw/zinc/32/57/01/322325701.db2.gz DHWUCGVHFPDCPU-MRXNPFEDSA-N 0 3 299.418 2.534 20 70 CFIDHN CN(C)CCn1ccc(NC(=O)C2CCC(C)(C)CC2)n1 ZINC000159790547 322328156 /nfs/dbraw/zinc/32/81/56/322328156.db2.gz VUOCXZYRBAYLON-UHFFFAOYSA-N 0 3 292.427 2.600 20 70 CFIDHN CCCCN(C)CCNC(=O)N[C@@H](CC)c1nccs1 ZINC000159812502 322328821 /nfs/dbraw/zinc/32/88/21/322328821.db2.gz WMCPLSLJUDPJNO-LBPRGKRZSA-N 0 3 298.456 2.625 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)C1CCC(C)CC1 ZINC000160560979 322339727 /nfs/dbraw/zinc/33/97/27/322339727.db2.gz SLFCRSZZQLPQAT-UHFFFAOYSA-N 0 3 275.458 2.710 20 70 CFIDHN CN(C(=O)C1CCC(C)(C)CC1)[C@@H]1CCCN(C)C1 ZINC000160678774 322341215 /nfs/dbraw/zinc/34/12/15/322341215.db2.gz DHUSONYMSBPGGT-CQSZACIVSA-N 0 3 266.429 2.755 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@H]1CCC[C@H](C)C1 ZINC000160795203 322342781 /nfs/dbraw/zinc/34/27/81/322342781.db2.gz JWLSDGDIUFPGND-KBPBESRZSA-N 0 3 275.458 2.710 20 70 CFIDHN C[C@H](CNC(=O)NC1(C)CCC1)N(C)Cc1ccccc1 ZINC000161118875 322347554 /nfs/dbraw/zinc/34/75/54/322347554.db2.gz ZYNIUCWSKTUYCD-CQSZACIVSA-N 0 3 289.423 2.749 20 70 CFIDHN CC(C)CC[C@@](C)(O)CN[C@H](C)c1cncs1 ZINC000159366211 519688090 /nfs/dbraw/zinc/68/80/90/519688090.db2.gz MRGPMLHPNGRZGC-DGCLKSJQSA-N 0 3 256.415 2.981 20 70 CFIDHN CCOCCCN1CCC[C@H]1c1ccc2c(c1)OCO2 ZINC000160462252 521706737 /nfs/dbraw/zinc/70/67/37/521706737.db2.gz YAVVPTYMCWWCSN-AWEZNQCLSA-N 0 3 277.364 2.979 20 70 CFIDHN CC[C@H](N[C@@H](CCO)CSC)c1ccccc1OC ZINC000160375150 522706215 /nfs/dbraw/zinc/70/62/15/522706215.db2.gz JRBRVYYUXKVODF-JSGCOSHPSA-N 0 3 283.437 2.850 20 70 CFIDHN CCn1cc([C@H](C)NC[C@H]2CC(=O)Nc3ccccc32)cn1 ZINC000160645593 523472827 /nfs/dbraw/zinc/47/28/27/523472827.db2.gz GEYKXRFYRQYNKH-QWHCGFSZSA-N 0 3 298.390 2.680 20 70 CFIDHN CCn1nc(CNCC(C)(C)OC)c2ccccc21 ZINC000160247143 523676204 /nfs/dbraw/zinc/67/62/04/523676204.db2.gz UMWXDNQHFZNLFF-UHFFFAOYSA-N 0 3 261.369 2.571 20 70 CFIDHN Cc1cccc([C@@H](C)N[C@@H](C)C(=O)NCC(F)(F)F)c1 ZINC000159837679 524829574 /nfs/dbraw/zinc/82/95/74/524829574.db2.gz APAYRXPDPBPQEB-MNOVXSKESA-N 0 3 288.313 2.713 20 70 CFIDHN Cc1cc(Cl)ccc1C(=O)N1CC[C@@H](N2CCCC2)C1 ZINC000161333036 524882172 /nfs/dbraw/zinc/88/21/72/524882172.db2.gz MDKXYMDIGQEYPV-CQSZACIVSA-N 0 3 292.810 2.959 20 70 CFIDHN Cc1cccc([C@H]2CCCN2Cc2ccc(C(N)=O)cc2)n1 ZINC000159810083 524895646 /nfs/dbraw/zinc/89/56/46/524895646.db2.gz ZPNCZNSTHAAPGG-QGZVFWFLSA-N 0 3 295.386 2.826 20 70 CFIDHN C[C@@H](NC[C@@H]1CC(=O)Nc2ccccc21)c1cncc(F)c1 ZINC000160682132 525477700 /nfs/dbraw/zinc/47/77/00/525477700.db2.gz HNAPIQNQNGUGHD-YPMHNXCESA-N 0 3 299.349 2.997 20 70 CFIDHN CSCCN(C)CCN(C)Cc1ccc(F)cc1 ZINC000160275638 525495800 /nfs/dbraw/zinc/49/58/00/525495800.db2.gz FQCGBLYWJOTDBM-UHFFFAOYSA-N 0 3 270.417 2.552 20 70 CFIDHN CSC[C@@H](CCO)N[C@H](C)c1ccc(C)cc1 ZINC000160396967 525642041 /nfs/dbraw/zinc/64/20/41/525642041.db2.gz AEIQYPQWJWNMJX-TZMCWYRMSA-N 0 3 253.411 2.760 20 70 CFIDHN C[C@H](O)C(C)(C)NCc1ccc(Br)s1 ZINC000160601279 525697311 /nfs/dbraw/zinc/69/73/11/525697311.db2.gz SJUNIUWDWJSSFL-ZETCQYMHSA-N 0 3 278.215 2.760 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC(c3nnc[nH]3)CC2)cc1 ZINC000160092145 526042791 /nfs/dbraw/zinc/04/27/91/526042791.db2.gz JMQPFDBJTIZJPW-UHFFFAOYSA-N 0 3 298.390 2.566 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC(c3nc[nH]n3)CC2)cc1 ZINC000160092145 526042799 /nfs/dbraw/zinc/04/27/99/526042799.db2.gz JMQPFDBJTIZJPW-UHFFFAOYSA-N 0 3 298.390 2.566 20 70 CFIDHN CCN1CCCN(C(=O)NCC2(CC)CCCC2)CC1 ZINC000159990531 529022634 /nfs/dbraw/zinc/02/26/34/529022634.db2.gz BVFNREDIZKHIGW-UHFFFAOYSA-N 0 3 281.444 2.694 20 70 CFIDHN CC(C)[C@@H]1CCCCN1C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000160625397 348019224 /nfs/dbraw/zinc/01/92/24/348019224.db2.gz WQARAVSITYZTDG-HOTGVXAUSA-N 0 3 293.455 2.691 20 70 CFIDHN Cc1ccc2c(c1)N(C(=O)N[C@H]1CCN(CC3CC3)C1)CC2 ZINC000160652378 348019729 /nfs/dbraw/zinc/01/97/29/348019729.db2.gz KBAKYBAQYYUAGO-INIZCTEOSA-N 0 3 299.418 2.551 20 70 CFIDHN CCO[C@H]1C[C@H](NCc2nn(C)c3ccccc23)C1(C)C ZINC000217879904 348165864 /nfs/dbraw/zinc/16/58/64/348165864.db2.gz CKQVJJGGWWUJBC-HOTGVXAUSA-N 0 3 287.407 2.867 20 70 CFIDHN CCN(CCN[C@H]1CCCc2cccnc21)C1CC1 ZINC000217482868 539644319 /nfs/dbraw/zinc/64/43/19/539644319.db2.gz BCHYFTQEEKOWSW-HNNXBMFYSA-N 0 3 259.397 2.533 20 70 CFIDHN Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)[C@@H](C)N)cc1 ZINC000161234781 188516472 /nfs/dbraw/zinc/51/64/72/188516472.db2.gz AURGJYPCEQUJAM-NFAWXSAZSA-N 0 3 260.381 2.642 20 70 CFIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@H]1CCC[C@H](C)C1 ZINC000160366124 295906564 /nfs/dbraw/zinc/90/65/64/295906564.db2.gz RDYRHDOSNIIEDN-KKUMJFAQSA-N 0 3 266.429 2.803 20 70 CFIDHN CCN(CCCCS(C)(=O)=O)Cc1ccccc1C ZINC000161428486 541630293 /nfs/dbraw/zinc/63/02/93/541630293.db2.gz ZHVOBFQLDFYGRY-UHFFFAOYSA-N 0 3 283.437 2.642 20 70 CFIDHN Cc1ccc([C@H](C)N(C)CCCCS(C)(=O)=O)cc1 ZINC000161467273 541647161 /nfs/dbraw/zinc/64/71/61/541647161.db2.gz REHXSLGYAMRCHE-AWEZNQCLSA-N 0 3 283.437 2.813 20 70 CFIDHN CN(CCCCc1ccccc1)CCCCS(C)(=O)=O ZINC000161484956 541653577 /nfs/dbraw/zinc/65/35/77/541653577.db2.gz YWQIPFJUHFCINZ-UHFFFAOYSA-N 0 3 297.464 2.766 20 70 CFIDHN CCN1CCC(NC(=O)[C@H]2C[C@H]2c2sccc2C)CC1 ZINC000159912362 378736752 /nfs/dbraw/zinc/73/67/52/378736752.db2.gz FTCKFDNGDLWQGB-KGLIPLIRSA-N 0 3 292.448 2.761 20 70 CFIDHN CC[C@H](NC[C@H](C)N1CCc2ccccc21)c1cnn(C)c1 ZINC000159903360 378736918 /nfs/dbraw/zinc/73/69/18/378736918.db2.gz RDDKSSAIUYDYJA-YOEHRIQHSA-N 0 3 298.434 2.912 20 70 CFIDHN C[C@@H](NC[C@H](C)N1CCc2ccccc21)c1cnn(C)c1 ZINC000159920978 378738314 /nfs/dbraw/zinc/73/83/14/378738314.db2.gz OZFNHOQQWRUWDT-UONOGXRCSA-N 0 3 284.407 2.522 20 70 CFIDHN CCCCNC(=O)c1ccc(CN[C@H](CC)COC)cc1 ZINC000160117455 378749680 /nfs/dbraw/zinc/74/96/80/378749680.db2.gz HIXFJBDTIDFUKI-MRXNPFEDSA-N 0 3 292.423 2.731 20 70 CFIDHN CN(C)C1CN(c2ncc(-c3ccccc3)s2)C1 ZINC000159539910 378715805 /nfs/dbraw/zinc/71/58/05/378715805.db2.gz CFEICPXEBSREDE-UHFFFAOYSA-N 0 3 259.378 2.560 20 70 CFIDHN Cc1c2ccccc2oc1[C@H](NC(=O)[C@@H](C)N)C(C)C ZINC000159696060 378724815 /nfs/dbraw/zinc/72/48/15/378724815.db2.gz HEVHRLACGVYTRY-BXUZGUMPSA-N 0 3 274.364 2.902 20 70 CFIDHN CSCC[C@@H](N)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000159724358 378726321 /nfs/dbraw/zinc/72/63/21/378726321.db2.gz LDNIMBRCQPPYDU-RBSFLKMASA-N 0 3 292.448 2.519 20 70 CFIDHN CCC[C@@H](N)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000159811515 378731334 /nfs/dbraw/zinc/73/13/34/378731334.db2.gz HZOMLMNITPCLER-GXTWGEPZSA-N 0 3 280.799 2.783 20 70 CFIDHN CC(C)[C@H](N)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000159812712 378731671 /nfs/dbraw/zinc/73/16/71/378731671.db2.gz NOQQKEZABVNVPM-JSGCOSHPSA-N 0 3 280.799 2.639 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc3c(c1)CCC3)CC2 ZINC000160383371 378768859 /nfs/dbraw/zinc/76/88/59/378768859.db2.gz YKLMBOJYXHFYOI-PXAZEXFGSA-N 0 3 296.418 2.741 20 70 CFIDHN CCc1nnc(C[NH2+][C@H](Cc2ccc(F)cc2)C(C)C)[n-]1 ZINC000160636728 378787369 /nfs/dbraw/zinc/78/73/69/378787369.db2.gz WBSMBLMPEKDVBH-CQSZACIVSA-N 0 3 290.386 2.863 20 70 CFIDHN CCc1nnc(CN[C@H](Cc2ccc(F)cc2)C(C)C)[nH]1 ZINC000160636728 378787373 /nfs/dbraw/zinc/78/73/73/378787373.db2.gz WBSMBLMPEKDVBH-CQSZACIVSA-N 0 3 290.386 2.863 20 70 CFIDHN CCCOc1cccc(CN(CCC)CCO)c1 ZINC000161222298 378831525 /nfs/dbraw/zinc/83/15/25/378831525.db2.gz DZDZQLDHRANMGH-UHFFFAOYSA-N 0 3 251.370 2.680 20 70 CFIDHN O=C(CCCNCc1ccc(Cl)cc1F)NC1CC1 ZINC000160857124 378804325 /nfs/dbraw/zinc/80/43/25/378804325.db2.gz KZEVNVNVZNUWPA-UHFFFAOYSA-N 0 3 284.762 2.628 20 70 CFIDHN COC[C@@H](Cc1ccccc1)N[C@H](CCO)c1ccccc1 ZINC000161027708 378816665 /nfs/dbraw/zinc/81/66/65/378816665.db2.gz WXTSOAKELPQGMU-RTBURBONSA-N 0 3 299.414 2.957 20 70 CFIDHN CC(C)(N)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000161134703 378824939 /nfs/dbraw/zinc/82/49/39/378824939.db2.gz ORXCHLCRNAPGQW-UHFFFAOYSA-N 0 3 276.380 2.822 20 70 CFIDHN Cc1ccccc1OCCN[C@H]1CCCc2c1cnn2C ZINC000161362607 378841457 /nfs/dbraw/zinc/84/14/57/378841457.db2.gz WSCLGTIDJJORAX-HNNXBMFYSA-N 0 3 285.391 2.775 20 70 CFIDHN COC(CN1CC[C@@H](C)C[C@@H]1c1ccc(C)o1)OC ZINC000161337731 378841733 /nfs/dbraw/zinc/84/17/33/378841733.db2.gz GXQZQALMUJUHOS-DGCLKSJQSA-N 0 3 267.369 2.980 20 70 CFIDHN CS[C@H](C)CC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000161496802 378851731 /nfs/dbraw/zinc/85/17/31/378851731.db2.gz UNJSTOILVHSYGF-CQSZACIVSA-N 0 3 294.464 2.718 20 70 CFIDHN CC(C)(C)CCNC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159724573 322327500 /nfs/dbraw/zinc/32/75/00/322327500.db2.gz NYHIBMGNIUAHDN-KBPBESRZSA-N 0 3 266.429 2.803 20 70 CFIDHN COc1ccc([C@H]2CCN(CCOCC3CC3)C2)cc1 ZINC000160032618 533206335 /nfs/dbraw/zinc/20/63/35/533206335.db2.gz SUCLLBVUBVYHDL-INIZCTEOSA-N 0 3 275.392 2.911 20 70 CFIDHN Cc1cccc([C@H]2CCCCCN2C(=O)[C@@H](C)N)c1 ZINC000160984342 394366805 /nfs/dbraw/zinc/36/68/05/394366805.db2.gz SMCCYTNIFZPSIR-UKRRQHHQSA-N 0 3 260.381 2.786 20 70 CFIDHN CC[C@@H](COC)N[C@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000159612463 286851613 /nfs/dbraw/zinc/85/16/13/286851613.db2.gz HRABSWQEOAQVOY-OCCSQVGLSA-N 0 3 299.436 2.556 20 70 CFIDHN CC(C)CC1(CNC(=O)[C@H](C(C)C)N(C)C)CC1 ZINC000159374202 275561661 /nfs/dbraw/zinc/56/16/61/275561661.db2.gz GUPTUPYCOGPWNO-ZDUSSCGKSA-N 0 3 254.418 2.515 20 70 CFIDHN CC[C@@H]1CCC[C@H](NC(=O)N2CCCN(CC)CC2)C1 ZINC000159894389 280305293 /nfs/dbraw/zinc/30/52/93/280305293.db2.gz WEJCGXJPTVUPAK-CABCVRRESA-N 0 3 281.444 2.692 20 70 CFIDHN C[C@H]1CCC[C@@H](C(=O)NC2CCN(C3CC3)CC2)C1 ZINC000159370685 322321848 /nfs/dbraw/zinc/32/18/48/322321848.db2.gz YJQQMHMAVRSMOJ-QWHCGFSZSA-N 0 3 264.413 2.556 20 70 CFIDHN CC[C@H](N)C(=O)Nc1ccc(Nc2nc(C)cs2)cc1 ZINC000159422617 322322456 /nfs/dbraw/zinc/32/24/56/322322456.db2.gz ZAXBVLZOVDIRQB-LBPRGKRZSA-N 0 3 290.392 2.871 20 70 CFIDHN CCN1CCC[C@H]1CNC(=O)[C@@H](C)OC1CCCCCC1 ZINC000159572723 322324511 /nfs/dbraw/zinc/32/45/11/322324511.db2.gz KDWHLXRROFUJBC-CABCVRRESA-N 0 3 296.455 2.715 20 70 CFIDHN CCN1CCC(NC(=O)[C@H](C)OC2CCCCCC2)CC1 ZINC000159585684 322324744 /nfs/dbraw/zinc/32/47/44/322324744.db2.gz GHPOQENKKNLMJQ-AWEZNQCLSA-N 0 3 296.455 2.715 20 70 CFIDHN Cc1ccc(F)c(CN2CCCC[C@@H]2CCO)c1 ZINC000159702863 322326927 /nfs/dbraw/zinc/32/69/27/322326927.db2.gz XBSYFNYZTPZFBN-CQSZACIVSA-N 0 3 251.345 2.871 20 70 CFIDHN C[C@@H](CN[C@@H](C)c1cnccn1)N1CCc2ccccc2C1 ZINC000159806786 322328728 /nfs/dbraw/zinc/32/87/28/322328728.db2.gz CGSUFVRILURWSX-GJZGRUSLSA-N 0 3 296.418 2.574 20 70 CFIDHN C/C(=C\c1ccc(Cl)cc1)CNCC(=O)NC(C)C ZINC000159903702 322330029 /nfs/dbraw/zinc/33/00/29/322330029.db2.gz GDCUSXIBFNMUEY-XYOKQWHBSA-N 0 3 280.799 2.858 20 70 CFIDHN CN1CCC(Oc2ccc(NCc3cccnc3)cn2)CC1 ZINC000160177492 322334055 /nfs/dbraw/zinc/33/40/55/322334055.db2.gz PRBRXGBRCWVCLE-UHFFFAOYSA-N 0 3 298.390 2.562 20 70 CFIDHN CCSCc1cccc(NC(=O)[C@@H](N)CC)c1 ZINC000161480766 322352453 /nfs/dbraw/zinc/35/24/53/322352453.db2.gz AXQDKNONGXWLDI-LBPRGKRZSA-N 0 3 252.383 2.616 20 70 CFIDHN CCCCN(CCOC)Cc1c(C)nc2ccccn21 ZINC000160322795 520535606 /nfs/dbraw/zinc/53/56/06/520535606.db2.gz CSFSEXXXHBEUQG-UHFFFAOYSA-N 0 3 275.396 2.891 20 70 CFIDHN CC1CCN(CCNC(=O)[C@H]2CCC[C@@H](C)C2)CC1 ZINC000160553077 521013287 /nfs/dbraw/zinc/01/32/87/521013287.db2.gz ODIYJYDJYYXVGV-CABCVRRESA-N 0 3 266.429 2.661 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H](C)CCC(C)(C)C)CC1 ZINC000159883651 521609513 /nfs/dbraw/zinc/60/95/13/521609513.db2.gz REANZWQRRAAEQT-CQSZACIVSA-N 0 3 283.460 2.938 20 70 CFIDHN COC[C@@H](C)NCc1cccc(-c2ccccn2)c1 ZINC000159742958 522250885 /nfs/dbraw/zinc/25/08/85/522250885.db2.gz KQOFPSSELALENL-CYBMUJFWSA-N 0 3 256.349 2.873 20 70 CFIDHN CCc1nnc(C[NH2+][C@H]2C[C@H](C)CC[C@@H]2C(C)C)[n-]1 ZINC000160545471 522358731 /nfs/dbraw/zinc/35/87/31/522358731.db2.gz MSMQTEBSCDJIQB-UPJWGTAASA-N 0 3 264.417 2.918 20 70 CFIDHN COCC1CCN(Cc2c(C)nc3ccccn32)CC1 ZINC000160374729 522935291 /nfs/dbraw/zinc/93/52/91/522935291.db2.gz XMCIGINFZAXKHQ-UHFFFAOYSA-N 0 3 273.380 2.501 20 70 CFIDHN COc1cc([C@H](C)NCCN2CCSCC2)ccc1F ZINC000218248190 522943020 /nfs/dbraw/zinc/94/30/20/522943020.db2.gz WHNIPGMXJKCYHH-LBPRGKRZSA-N 0 3 298.427 2.534 20 70 CFIDHN CO[C@@]1(C)C[C@@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160899391 523809842 /nfs/dbraw/zinc/80/98/42/523809842.db2.gz GRVSLKZOXLOPRS-PBHICJAKSA-N 0 3 287.407 2.970 20 70 CFIDHN Cc1cccc([C@@H](C)NC[C@H](O)COCC(C)C)c1 ZINC000160225866 524830615 /nfs/dbraw/zinc/83/06/15/524830615.db2.gz RCSTXPNXPMEGDC-ZBFHGGJFSA-N 0 3 265.397 2.679 20 70 CFIDHN CSCCN(C)CCC(=O)c1ccc(C)cc1 ZINC000159671295 525496117 /nfs/dbraw/zinc/49/61/17/525496117.db2.gz IITYFUPDDWPZCN-UHFFFAOYSA-N 0 3 251.395 2.863 20 70 CFIDHN C[C@@H](NC[C@H]1CC(=O)Nc2ccccc21)c1cncc(F)c1 ZINC000160682358 525499636 /nfs/dbraw/zinc/49/96/36/525499636.db2.gz HNAPIQNQNGUGHD-DGCLKSJQSA-N 0 3 299.349 2.997 20 70 CFIDHN CSC[C@H](CCO)N[C@H](C)c1ccc(C)cc1 ZINC000160396712 525699216 /nfs/dbraw/zinc/69/92/16/525699216.db2.gz AEIQYPQWJWNMJX-OCCSQVGLSA-N 0 3 253.411 2.760 20 70 CFIDHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCCC1(C)C ZINC000159486584 528896826 /nfs/dbraw/zinc/89/68/26/528896826.db2.gz GYTOWGXIEZNZEK-CYBMUJFWSA-N 0 3 269.433 2.547 20 70 CFIDHN CN(CCOCC1CC1)CCc1ccc(F)cc1 ZINC000159560173 529922335 /nfs/dbraw/zinc/92/23/35/529922335.db2.gz OTWQMEMQEAHNSP-UHFFFAOYSA-N 0 3 251.345 2.727 20 70 CFIDHN Cc1ccc(Cl)c(OC[C@@H](O)CN2CCCCC2)c1 ZINC000159508985 232244344 /nfs/dbraw/zinc/24/43/44/232244344.db2.gz TVZAGAADBABGFQ-ZDUSSCGKSA-N 0 3 283.799 2.874 20 70 CFIDHN Cc1nccc(NC(=O)NC[C@H]2CCCN(C)C2)c1Cl ZINC000159483828 539825739 /nfs/dbraw/zinc/82/57/39/539825739.db2.gz LTNPGPJSWILLCG-LLVKDONJSA-N 0 3 296.802 2.507 20 70 CFIDHN Cc1cccc([C@H]2CCCCCN2C(=O)[C@H](C)N)c1 ZINC000160983502 188501997 /nfs/dbraw/zinc/50/19/97/188501997.db2.gz SMCCYTNIFZPSIR-DZGCQCFKSA-N 0 3 260.381 2.786 20 70 CFIDHN CC(C)[C@H]1CCN(C(=O)Nc2cccc(CN)c2)C1 ZINC000160979799 540685310 /nfs/dbraw/zinc/68/53/10/540685310.db2.gz UGPWERZOIOIXDZ-ZDUSSCGKSA-N 0 3 261.369 2.655 20 70 CFIDHN Cc1cccc(OCCN2CCN(c3ccncc3)CC2)c1 ZINC000161322480 541585459 /nfs/dbraw/zinc/58/54/59/541585459.db2.gz MHOIQXFVUMDUHV-UHFFFAOYSA-N 0 3 297.402 2.591 20 70 CFIDHN CCN1CCC(NC(=O)[C@H]2C[C@@H]2c2sccc2C)CC1 ZINC000159912112 378737783 /nfs/dbraw/zinc/73/77/83/378737783.db2.gz FTCKFDNGDLWQGB-KBPBESRZSA-N 0 3 292.448 2.761 20 70 CFIDHN C[C@@H](NCCC(C)(C)O)c1cnn(Cc2ccccc2)c1 ZINC000159964160 378740608 /nfs/dbraw/zinc/74/06/08/378740608.db2.gz YARJVHOLDQKXJS-CQSZACIVSA-N 0 3 287.407 2.743 20 70 CFIDHN Cc1ccc(NC(=O)[C@H]2CCCCN2)cc1OC(F)F ZINC000160091321 378748616 /nfs/dbraw/zinc/74/86/16/378748616.db2.gz TYSKIMCPPPTNRH-LLVKDONJSA-N 0 3 284.306 2.677 20 70 CFIDHN Cn1c(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)nc2ccccc21 ZINC000159571319 378716772 /nfs/dbraw/zinc/71/67/72/378716772.db2.gz UETVFZYZLOFARS-ZLIFDBKOSA-N 0 3 297.402 2.621 20 70 CFIDHN Cc1ccc([C@@H](C)CNC(=O)[C@@H](N)CC(C)C)cc1 ZINC000159655583 378722881 /nfs/dbraw/zinc/72/28/81/378722881.db2.gz RYIRGXQOUSHHCB-ZFWWWQNUSA-N 0 3 262.397 2.588 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000159716707 378725681 /nfs/dbraw/zinc/72/56/81/378725681.db2.gz LDNIMBRCQPPYDU-ILXRZTDVSA-N 0 3 292.448 2.519 20 70 CFIDHN CCc1nc(CN[C@H](CC)c2ccc(C)cc2)n[nH]1 ZINC000160273245 378760921 /nfs/dbraw/zinc/76/09/21/378760921.db2.gz GUFXVBSXGLHYFB-CYBMUJFWSA-N 0 3 258.369 2.916 20 70 CFIDHN CCc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1 ZINC000160332432 378764035 /nfs/dbraw/zinc/76/40/35/378764035.db2.gz ZIPOWMFLYRODMU-WBMJQRKESA-N 0 3 284.407 2.815 20 70 CFIDHN CCc1ccc(/C=C/C(=O)N(C)[C@H]2CCN(C)C[C@@H]2C)o1 ZINC000160416190 378770790 /nfs/dbraw/zinc/77/07/90/378770790.db2.gz MFDMYBCGJZEBNH-OPIZNEOISA-N 0 3 290.407 2.654 20 70 CFIDHN COc1ccsc1C(=O)NC[C@H]1CCCN1CC(C)C ZINC000160437141 378772254 /nfs/dbraw/zinc/77/22/54/378772254.db2.gz WTJXZCVIKRBPII-GFCCVEGCSA-N 0 3 296.436 2.607 20 70 CFIDHN COc1cccc(CN[C@@H]2CCOC(C)(C)C2)c1OC ZINC000160470176 378773912 /nfs/dbraw/zinc/77/39/12/378773912.db2.gz WKUDQKNEACIJTL-CYBMUJFWSA-N 0 3 279.380 2.751 20 70 CFIDHN COc1ccc([C@@H](C)CCNC(=O)[C@@H](N)C(C)(C)C)cc1 ZINC000160553232 378781142 /nfs/dbraw/zinc/78/11/42/378781142.db2.gz YUFWSBAHACCTPM-SWLSCSKDSA-N 0 3 292.423 2.678 20 70 CFIDHN COc1ccc(Cl)cc1[C@@H](C)NCC(C)(C)O ZINC000160643770 378788274 /nfs/dbraw/zinc/78/82/74/378788274.db2.gz JVHQBCRUAMRADV-SECBINFHSA-N 0 3 257.761 2.770 20 70 CFIDHN CC[C@H](N)C(=O)Nc1cccc(Cl)c1OC(C)C ZINC000160922744 378809826 /nfs/dbraw/zinc/80/98/26/378809826.db2.gz IQUBXEHAKRXVFC-JTQLQIEISA-N 0 3 270.760 2.803 20 70 CFIDHN COC(C)(C)C[C@@H](C)NC(=O)[C@H](C)[C@H](N)c1ccccc1 ZINC000160966675 378812038 /nfs/dbraw/zinc/81/20/38/378812038.db2.gz KPFSLHDREJERLQ-NFAWXSAZSA-N 0 3 292.423 2.642 20 70 CFIDHN CCN(CC(OC)OC)[C@H](C)Cc1ccc(OC)cc1 ZINC000161035305 378816890 /nfs/dbraw/zinc/81/68/90/378816890.db2.gz FFNJMJZOIIGFRQ-CYBMUJFWSA-N 0 3 281.396 2.567 20 70 CFIDHN COc1cc(CNC(C)(C)[C@H](C)O)c(SC)cc1OC ZINC000161117072 378823262 /nfs/dbraw/zinc/82/32/62/378823262.db2.gz BTXTUHSKXILNCN-JTQLQIEISA-N 0 3 299.436 2.675 20 70 CFIDHN Cc1ccc(SCC(F)(F)F)c(NC(=O)[C@H](C)N)c1 ZINC000161131989 378824485 /nfs/dbraw/zinc/82/44/85/378824485.db2.gz IHTZUZCTGATDRC-QMMMGPOBSA-N 0 3 292.326 2.935 20 70 CFIDHN CC[C@@H](C)NC(=O)c1cccc(CN[C@H](CC)COC)c1 ZINC000161136079 378824519 /nfs/dbraw/zinc/82/45/19/378824519.db2.gz LIDAHZLXTGUPEB-CZUORRHYSA-N 0 3 292.423 2.730 20 70 CFIDHN CC[C@H](C)[C@H](N)C(=O)NC[C@@H](C)Oc1ccc(Cl)cc1 ZINC000161137776 378825122 /nfs/dbraw/zinc/82/51/22/378825122.db2.gz HQFOUCDKZNGQQU-WDMOLILDSA-N 0 3 298.814 2.597 20 70 CFIDHN Cc1ccc([C@H](C)CNC(=O)[C@H](N)Cc2ccccc2)cc1 ZINC000161169472 378827048 /nfs/dbraw/zinc/82/70/48/378827048.db2.gz WGDSCPBOEDAWAX-CRAIPNDOSA-N 0 3 296.414 2.785 20 70 CFIDHN CCN1CCCC[C@@H]1CN[C@@H](C)c1cnc(C)nc1C ZINC000161174410 378827355 /nfs/dbraw/zinc/82/73/55/378827355.db2.gz MJFNJYCLNIBFES-SWLSCSKDSA-N 0 3 276.428 2.618 20 70 CFIDHN COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)[C@H](C)N ZINC000161415182 378845095 /nfs/dbraw/zinc/84/50/95/378845095.db2.gz NYBZDQCZHCIBOV-GWCFXTLKSA-N 0 3 298.814 2.899 20 70 CFIDHN CCCCN(C[C@H]1CC=CCC1)[C@@H]1CCS(=O)(=O)C1 ZINC000160758400 322342548 /nfs/dbraw/zinc/34/25/48/322342548.db2.gz UCUOUQZMFDNOCQ-LSDHHAIUSA-N 0 3 285.453 2.632 20 70 CFIDHN C[C@@H]1CCC[C@H](N[C@@H](C(N)=O)c2ccc(F)cc2)[C@@H]1C ZINC000217950767 382788465 /nfs/dbraw/zinc/78/84/65/382788465.db2.gz TXBIONRQVSABBY-HKCMKHECSA-N 0 3 278.371 2.766 20 70 CFIDHN C[C@H](Cn1cccn1)NCc1cccc2cc[nH]c21 ZINC000218102646 382789275 /nfs/dbraw/zinc/78/92/75/382789275.db2.gz QZQOMBWDUISCRO-GFCCVEGCSA-N 0 3 254.337 2.543 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H]2CC[C@H](C)C[C@@H]2C)CC1 ZINC000159857871 285213269 /nfs/dbraw/zinc/21/32/69/285213269.db2.gz WYDLMOAISLPJNV-SOUVJXGZSA-N 0 3 281.444 2.548 20 70 CFIDHN O[C@@H]1CCCC[C@H]1CN[C@@H]1CCCc2cccnc21 ZINC000217744770 413063965 /nfs/dbraw/zinc/06/39/65/413063965.db2.gz TZADZTCWOZQMOW-RRFJBIMHSA-N 0 3 260.381 2.600 20 70 CFIDHN Cc1cc(C)cc([C@@H](C)NCC(=O)NCC(F)(F)F)c1 ZINC000160519376 394366663 /nfs/dbraw/zinc/36/66/63/394366663.db2.gz QCLSMAXFFMKMKU-LLVKDONJSA-N 0 3 288.313 2.633 20 70 CFIDHN Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)[C@@H](C)N)cc1 ZINC000161235004 292237050 /nfs/dbraw/zinc/23/70/50/292237050.db2.gz AURGJYPCEQUJAM-GUTXKFCHSA-N 0 3 260.381 2.642 20 70 CFIDHN C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)[C@@H](N)C(C)(C)C ZINC000159802834 279002026 /nfs/dbraw/zinc/00/20/26/279002026.db2.gz FRONBGOBJUXJHC-OSAQELSMSA-N 0 3 292.398 2.904 20 70 CFIDHN COC[C@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161149408 293035759 /nfs/dbraw/zinc/03/57/59/293035759.db2.gz GIHYPISAXFJKKU-MEDUHNTESA-N 0 3 277.364 2.533 20 70 CFIDHN CCSCc1cccc(NC(=O)C(C)(C)N)c1 ZINC000161480102 322352602 /nfs/dbraw/zinc/35/26/02/322352602.db2.gz SNQDLENRHFNYHO-UHFFFAOYSA-N 0 3 252.383 2.616 20 70 CFIDHN CC1CCC(CN(C)C[C@H](O)C(F)(F)F)CC1 ZINC000159558453 322324017 /nfs/dbraw/zinc/32/40/17/322324017.db2.gz VUNDZZOOQLXZHL-ILDUYXDCSA-N 0 3 253.308 2.668 20 70 CFIDHN CCOC[C@@H](O)CN[C@@H](C)c1ccc(SCC)cc1 ZINC000159637828 322325722 /nfs/dbraw/zinc/32/57/22/322325722.db2.gz SWQAGQCJSGUYFA-JSGCOSHPSA-N 0 3 283.437 2.847 20 70 CFIDHN Cc1ccc(F)c(CN2CCCC[C@H]2CCO)c1 ZINC000159703001 322326741 /nfs/dbraw/zinc/32/67/41/322326741.db2.gz XBSYFNYZTPZFBN-AWEZNQCLSA-N 0 3 251.345 2.871 20 70 CFIDHN C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCC1(C2CC2)CC1 ZINC000159751019 322327545 /nfs/dbraw/zinc/32/75/45/322327545.db2.gz ZOQWXVRNKGTVLZ-ZIAGYGMSSA-N 0 3 293.455 2.596 20 70 CFIDHN CC(C)OC(=O)CCN(CCc1nccs1)C(C)C ZINC000159857215 322329316 /nfs/dbraw/zinc/32/93/16/322329316.db2.gz VUQVNPGYJUSFIG-UHFFFAOYSA-N 0 3 284.425 2.738 20 70 CFIDHN COc1ccnc(CN(CCc2nccs2)C(C)C)c1 ZINC000159908968 322329820 /nfs/dbraw/zinc/32/98/20/322329820.db2.gz YMTOMEBMZCJOBW-UHFFFAOYSA-N 0 3 291.420 3.000 20 70 CFIDHN CC(C)N(CCOC[C@@H]1CCCO1)CCc1nccs1 ZINC000159943137 322330270 /nfs/dbraw/zinc/33/02/70/322330270.db2.gz OPGMKQKSGBGZEX-AWEZNQCLSA-N 0 3 298.452 2.592 20 70 CFIDHN CN1CCC(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)CC1 ZINC000160244310 322335278 /nfs/dbraw/zinc/33/52/78/322335278.db2.gz FIUKUXANKKLNSR-RBSFLKMASA-N 0 3 278.440 2.803 20 70 CFIDHN Cc1nc2ccccn2c1CN1C[C@@H](C)S[C@@H](C)C1 ZINC000160815133 322343339 /nfs/dbraw/zinc/34/33/39/322343339.db2.gz NNZBKZKAGJBPPE-TXEJJXNPSA-N 0 3 275.421 2.969 20 70 CFIDHN COc1ccc([C@H](C)N[C@H]2CCC(=O)N(C)C2)cc1Cl ZINC000161204128 322348820 /nfs/dbraw/zinc/34/88/20/322348820.db2.gz MQXWJWHRDCRHHY-JQWIXIFHSA-N 0 3 296.798 2.620 20 70 CFIDHN CCOC(=O)[C@@H]1CCCCN1C[C@H]1CC=CCC1 ZINC000161250123 322349422 /nfs/dbraw/zinc/34/94/22/322349422.db2.gz ZTDGIFVAOODPKX-KBPBESRZSA-N 0 3 251.370 2.760 20 70 CFIDHN CC(C)[C@H](N)C(=O)Nc1ccc2nn(C(C)C)cc2c1 ZINC000160069645 519817624 /nfs/dbraw/zinc/81/76/24/519817624.db2.gz DBVOIIUIFKQEIY-AWEZNQCLSA-N 0 3 274.368 2.539 20 70 CFIDHN CCCN1CCCN(C(=O)c2ccc3ncccc3c2)CC1 ZINC000160373116 519850782 /nfs/dbraw/zinc/85/07/82/519850782.db2.gz SCJFJIQEOGEFTK-UHFFFAOYSA-N 0 3 297.402 2.793 20 70 CFIDHN CC(C)n1cc([C@@H](C)NC[C@@H]2CCCC[C@@H]2O)cn1 ZINC000160621600 519973547 /nfs/dbraw/zinc/97/35/47/519973547.db2.gz WLCGBAWUJVQHCL-IPYPFGDCSA-N 0 3 265.401 2.666 20 70 CFIDHN CCCCCOc1ccc([C@H](C)NCCO)cc1 ZINC000159712572 520258980 /nfs/dbraw/zinc/25/89/80/520258980.db2.gz OOXJVJQWQKESFG-ZDUSSCGKSA-N 0 3 251.370 2.899 20 70 CFIDHN CCCCSCCC(=O)N1CCN(C2CCCC2)CC1 ZINC000159512814 520947231 /nfs/dbraw/zinc/94/72/31/520947231.db2.gz UKORPPAKFQKPHT-UHFFFAOYSA-N 0 3 298.496 2.997 20 70 CFIDHN COc1ccc(CC2CCN(CC(OC)OC)CC2)cc1 ZINC000160774169 523915212 /nfs/dbraw/zinc/91/52/12/523915212.db2.gz MICQFUXZJIGQBZ-UHFFFAOYSA-N 0 3 293.407 2.569 20 70 CFIDHN C[C@@H]1CCC[C@H](C(=O)NCCN2CCCCCC2)C1 ZINC000160221987 524346268 /nfs/dbraw/zinc/34/62/68/524346268.db2.gz XOLCUAVEMPATRO-CABCVRRESA-N 0 3 266.429 2.805 20 70 CFIDHN Cc1ccc(CN2CCC(c3ccnn3CCO)CC2)cc1 ZINC000160657821 524439628 /nfs/dbraw/zinc/43/96/28/524439628.db2.gz WGDBWWBTNYICAB-UHFFFAOYSA-N 0 3 299.418 2.563 20 70 CFIDHN Cc1cccc([C@@H]2CCCN2Cc2ccc(C(N)=O)cc2)n1 ZINC000159809976 524850117 /nfs/dbraw/zinc/85/01/17/524850117.db2.gz ZPNCZNSTHAAPGG-KRWDZBQOSA-N 0 3 295.386 2.826 20 70 CFIDHN Cc1cccc([C@H](C)NC[C@@H](O)COCC(C)C)c1 ZINC000160251644 524872704 /nfs/dbraw/zinc/87/27/04/524872704.db2.gz RCSTXPNXPMEGDC-GOEBONIOSA-N 0 3 265.397 2.679 20 70 CFIDHN Cc1cccc([C@H]2CCCN2CCC(=O)OC(C)C)n1 ZINC000159706115 524894923 /nfs/dbraw/zinc/89/49/23/524894923.db2.gz SYPWYWMZFCYCGC-OAHLLOKOSA-N 0 3 276.380 2.869 20 70 CFIDHN CSCC[C@@H](N)C(=O)N[C@H](C)CCC1CCCCC1 ZINC000160916120 525544659 /nfs/dbraw/zinc/54/46/59/525544659.db2.gz IMIZHPGMFKFWRM-TZMCWYRMSA-N 0 3 286.485 2.932 20 70 CFIDHN c1cc([C@H]2CCCN2CCOCC2CC2)cc2c1OCO2 ZINC000160460249 526437811 /nfs/dbraw/zinc/43/78/11/526437811.db2.gz HNTNWVSUOKNURF-OAHLLOKOSA-N 0 3 289.375 2.979 20 70 CFIDHN NC(=O)CC1CCN(Cc2coc3ccccc23)CC1 ZINC000159746252 526861994 /nfs/dbraw/zinc/86/19/94/526861994.db2.gz XRCSGBNKVCIQEP-UHFFFAOYSA-N 0 3 272.348 2.520 20 70 CFIDHN Cc1nc2ccccn2c1CN(C)C[C@H]1CCCOC1 ZINC000160247090 527175682 /nfs/dbraw/zinc/17/56/82/527175682.db2.gz WYVRSCOSACWDJY-CQSZACIVSA-N 0 3 273.380 2.501 20 70 CFIDHN CCCN1CCC[C@@H]1C(=O)NCCc1cc2ccccc2[nH]1 ZINC000160948859 528221160 /nfs/dbraw/zinc/22/11/60/528221160.db2.gz RKEPJPAIWRYQCI-QGZVFWFLSA-N 0 3 299.418 2.701 20 70 CFIDHN CCN1CCCC[C@@H]1C(=O)NCCc1cc2ccccc2[nH]1 ZINC000159661952 528992110 /nfs/dbraw/zinc/99/21/10/528992110.db2.gz FTSVGOULPQHTLW-QGZVFWFLSA-N 0 3 299.418 2.701 20 70 CFIDHN Cc1c(CNCc2c(C)cc(C)cc2C)cnn1C ZINC000161307500 232250932 /nfs/dbraw/zinc/25/09/32/232250932.db2.gz IPMDPPNKTHQTBV-UHFFFAOYSA-N 0 3 257.381 2.944 20 70 CFIDHN CSCC[C@@H](C)N(C)C(=O)c1cccc2c1CCNC2 ZINC000161258718 348024194 /nfs/dbraw/zinc/02/41/94/348024194.db2.gz MAWKTVSWHYRMEB-GFCCVEGCSA-N 0 3 292.448 2.546 20 70 CFIDHN Cc1ccc([O-])c(C(=O)NCC[NH+]2[C@H](C)CCC[C@H]2C)c1 ZINC000217732428 348165191 /nfs/dbraw/zinc/16/51/91/348165191.db2.gz FCQRLPVCRQVUFY-ZIAGYGMSSA-N 0 3 290.407 2.693 20 70 CFIDHN Cc1cc(C)cc(CCN[C@H](C)c2cnccn2)c1 ZINC000159476024 188427513 /nfs/dbraw/zinc/42/75/13/188427513.db2.gz ZJIYGJYTPVSTDE-CQSZACIVSA-N 0 3 255.365 2.987 20 70 CFIDHN CC(C)C[C@@H](N)C(=O)N1CCSC2(CCCCC2)C1 ZINC000161449118 540693597 /nfs/dbraw/zinc/69/35/97/540693597.db2.gz OFONGDOUVRTORY-CYBMUJFWSA-N 0 3 284.469 2.638 20 70 CFIDHN CC(C)C[C@@H](N)C(=O)N(C)Cc1cc2ccccc2o1 ZINC000161413365 540693073 /nfs/dbraw/zinc/69/30/73/540693073.db2.gz CITKMWSJKGKNTC-CQSZACIVSA-N 0 3 274.364 2.765 20 70 CFIDHN CCn1nccc1CNC[C@H]1CCN(c2ccccc2)C1 ZINC000159975505 541019182 /nfs/dbraw/zinc/01/91/82/541019182.db2.gz NBQZAJHMKHUIJY-OAHLLOKOSA-N 0 3 284.407 2.519 20 70 CFIDHN C[C@H](CN[C@@H](C)c1cnn(C)c1)N1CCc2ccccc21 ZINC000159920856 378738291 /nfs/dbraw/zinc/73/82/91/378738291.db2.gz OZFNHOQQWRUWDT-KGLIPLIRSA-N 0 3 284.407 2.522 20 70 CFIDHN CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@H]1CCOC1 ZINC000160066764 378746931 /nfs/dbraw/zinc/74/69/31/378746931.db2.gz NLYCVRJDHNCLNH-HNNXBMFYSA-N 0 3 291.391 2.863 20 70 CFIDHN C[C@@]1(c2ccccc2)CCCN(C(=O)[C@H]2CCCCN2)C1 ZINC000160101877 378748842 /nfs/dbraw/zinc/74/88/42/378748842.db2.gz FMMPMSHSWKMAOQ-SJLPKXTDSA-N 0 3 286.419 2.709 20 70 CFIDHN CCOc1cccc(CN[C@H](C)CC(=O)N(CC)CC)c1 ZINC000159408742 378706917 /nfs/dbraw/zinc/70/69/17/378706917.db2.gz GJJAEBHFMUXCER-CQSZACIVSA-N 0 3 292.423 2.822 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC([C@H](C)O)CC2)cc1 ZINC000159619054 378719758 /nfs/dbraw/zinc/71/97/58/378719758.db2.gz QLCNLJQHZPPVAT-AWEZNQCLSA-N 0 3 275.392 2.661 20 70 CFIDHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CCCCC1(C)C ZINC000159606160 378720325 /nfs/dbraw/zinc/72/03/25/378720325.db2.gz GBFNVCNWBMUFLV-AWEZNQCLSA-N 0 3 283.460 2.937 20 70 CFIDHN C[C@@H](NC(=O)[C@@H]1CCCCN1)c1ccc(F)cc1Cl ZINC000159627791 378721533 /nfs/dbraw/zinc/72/15/33/378721533.db2.gz NMPKIBMDSWIUBV-RNCFNFMXSA-N 0 3 284.762 2.798 20 70 CFIDHN COc1ccccc1CN[C@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000159657608 378723035 /nfs/dbraw/zinc/72/30/35/378723035.db2.gz IIMUARZOOYYOEX-BPUTZDHNSA-N 0 3 273.376 2.742 20 70 CFIDHN CCOc1ccc([C@@H](CC)NCCO)cc1OCC ZINC000159713821 378725914 /nfs/dbraw/zinc/72/59/14/378725914.db2.gz AAARFUYTEXAXAM-CYBMUJFWSA-N 0 3 267.369 2.517 20 70 CFIDHN CCC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2C)C1 ZINC000159819609 378731644 /nfs/dbraw/zinc/73/16/44/378731644.db2.gz QWZKGNDDNZEPHV-KBPBESRZSA-N 0 3 260.381 2.657 20 70 CFIDHN O=C([C@H]1CCCCN1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000159805951 378732579 /nfs/dbraw/zinc/73/25/79/378732579.db2.gz JCUCUVITYKVDOO-UKRRQHHQSA-N 0 3 292.810 2.798 20 70 CFIDHN CCc1nc(CN[C@@H](c2ccc(OC)cc2)C(C)C)n[nH]1 ZINC000160281888 378760893 /nfs/dbraw/zinc/76/08/93/378760893.db2.gz YDJGCDOLNVESFH-MRXNPFEDSA-N 0 3 288.395 2.863 20 70 CFIDHN CC(C)N(C)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160380392 378766104 /nfs/dbraw/zinc/76/61/04/378766104.db2.gz XCBZKZPTLOSQNC-GDBMZVCRSA-N 0 3 289.423 2.699 20 70 CFIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)NC1CCCC1 ZINC000160532962 378779189 /nfs/dbraw/zinc/77/91/89/378779189.db2.gz KPDIDGMTQBDGOJ-OLZOCXBDSA-N 0 3 254.418 2.802 20 70 CFIDHN COc1cccc(CN2CC[C@]3(O)CCCC[C@@H]3C2)c1 ZINC000160795231 378800860 /nfs/dbraw/zinc/80/08/60/378800860.db2.gz DGRQNTBPMNIDNF-NVXWUHKLSA-N 0 3 275.392 2.822 20 70 CFIDHN COc1ccccc1CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000160799547 378800890 /nfs/dbraw/zinc/80/08/90/378800890.db2.gz HIHSZJTXGMJFPO-WBVHZDCISA-N 0 3 275.392 2.822 20 70 CFIDHN CC(C)[C@@H](NC(=O)[C@H](C)N)c1ccccc1Cl ZINC000160829242 378802597 /nfs/dbraw/zinc/80/25/97/378802597.db2.gz VHLDHUPSFIXELI-JOYOIKCWSA-N 0 3 254.761 2.501 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@@H](C)CCC1CCCCC1 ZINC000160916242 378810166 /nfs/dbraw/zinc/81/01/66/378810166.db2.gz IMIZHPGMFKFWRM-JSGCOSHPSA-N 0 3 286.485 2.932 20 70 CFIDHN CC(C)[C@H](N)C(=O)Nc1cc(C2CCCCCC2)[nH]n1 ZINC000161071784 378819506 /nfs/dbraw/zinc/81/95/06/378819506.db2.gz PYQXBDFHTDBZHD-AWEZNQCLSA-N 0 3 278.400 2.769 20 70 CFIDHN C[C@H](O)C(C)(C)NCc1cc(Cl)c2c(c1)OCCCO2 ZINC000161136589 378824900 /nfs/dbraw/zinc/82/49/00/378824900.db2.gz WHNHQJAFFMDKLN-JTQLQIEISA-N 0 3 299.798 2.750 20 70 CFIDHN CC[C@H](C)NC(=O)c1cccc(CN[C@@H](CC)COC)c1 ZINC000161135949 378824912 /nfs/dbraw/zinc/82/49/12/378824912.db2.gz LIDAHZLXTGUPEB-BBRMVZONSA-N 0 3 292.423 2.730 20 70 CFIDHN CS[C@H](C)CC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000161377932 378843329 /nfs/dbraw/zinc/84/33/29/378843329.db2.gz HLDNGRBEEZUZJQ-UKRRQHHQSA-N 0 3 294.464 2.856 20 70 CFIDHN C[C@@H](C(=O)NCCC1=CCCC1)N1CCCCCC1 ZINC000160233526 322335069 /nfs/dbraw/zinc/33/50/69/322335069.db2.gz QSJKJNLWWKASSB-AWEZNQCLSA-N 0 3 264.413 2.868 20 70 CFIDHN C[C@H](N)C(=O)N[C@H](CC1CCCCC1)C(C)(C)C ZINC000160073357 394366147 /nfs/dbraw/zinc/36/61/47/394366147.db2.gz BFMGYLUCCGFUCA-WCQYABFASA-N 0 3 254.418 2.835 20 70 CFIDHN CC[C@H](N)C(=O)NCCc1cccc(-c2ccccc2)c1 ZINC000160514531 394366515 /nfs/dbraw/zinc/36/65/15/394366515.db2.gz DAEJIFLCOUNBCH-KRWDZBQOSA-N 0 3 282.387 2.750 20 70 CFIDHN COc1c(C)cnc(CN(C[C@@H]2CCOC2)C2CC2)c1C ZINC000160968769 286182107 /nfs/dbraw/zinc/18/21/07/286182107.db2.gz KEAJYEKJJDYCPQ-AWEZNQCLSA-N 0 3 290.407 2.708 20 70 CFIDHN COc1ccc(C)cc1CN(C)C[C@H]1CCC[C@@H]1O ZINC000159458874 322322970 /nfs/dbraw/zinc/32/29/70/322322970.db2.gz QXXJZDRJRWCXOM-HIFRSBDPSA-N 0 3 263.381 2.596 20 70 CFIDHN Cc1ccccc1[C@H](C)NCCOC[C@@H]1CCCO1 ZINC000159644119 322325894 /nfs/dbraw/zinc/32/58/94/322325894.db2.gz UEGGNUXHICDCSL-GJZGRUSLSA-N 0 3 263.381 2.841 20 70 CFIDHN CC1(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1 ZINC000159669032 322326459 /nfs/dbraw/zinc/32/64/59/322326459.db2.gz BDVODNRTXIDAMQ-LBPRGKRZSA-N 0 3 278.421 2.801 20 70 CFIDHN CCSCC[C@H](C)NC(=O)[C@@H]1CNCc2ccccc21 ZINC000160208702 322334533 /nfs/dbraw/zinc/33/45/33/322334533.db2.gz WDXYFKKIUWLOSN-SWLSCSKDSA-N 0 3 292.448 2.521 20 70 CFIDHN COC[C@@H](NCC(C)(C)O)c1cccc(C(F)(F)F)c1 ZINC000160628230 322340731 /nfs/dbraw/zinc/34/07/31/322340731.db2.gz NKCFYZZTKQRJRR-GFCCVEGCSA-N 0 3 291.313 2.753 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@@H]1CCCC[C@@H]1C ZINC000160756530 322342322 /nfs/dbraw/zinc/34/23/22/322342322.db2.gz WCHGHBCJHXZRRT-UONOGXRCSA-N 0 3 275.458 2.710 20 70 CFIDHN C[C@@H](c1cccnc1)N(C)C(=O)c1ccc(CN(C)C)cc1 ZINC000161493635 322352260 /nfs/dbraw/zinc/35/22/60/322352260.db2.gz YKTKLKVCNRYURP-AWEZNQCLSA-N 0 3 297.402 2.976 20 70 CFIDHN CCCN1CCCN(C(=O)C2CCCCC2)CC1 ZINC000160384744 519848411 /nfs/dbraw/zinc/84/84/11/519848411.db2.gz PDRUVFFTVBSLJI-UHFFFAOYSA-N 0 3 252.402 2.511 20 70 CFIDHN CC(C)C(=O)N[C@@H]1CCCN(CCC2CCCC2)C1 ZINC000160126730 519510062 /nfs/dbraw/zinc/51/00/62/519510062.db2.gz AMRRWVZKOQHBEH-OAHLLOKOSA-N 0 3 266.429 2.803 20 70 CFIDHN CCO[C@H]1C[C@@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160570144 520541603 /nfs/dbraw/zinc/54/16/03/520541603.db2.gz AGFVRXUSVUMGFY-CABCVRRESA-N 0 3 287.407 2.970 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H](C)C2CCCCC2)CC1 ZINC000159901471 521609308 /nfs/dbraw/zinc/60/93/08/521609308.db2.gz PYBXXKXKSFHQBS-CQSZACIVSA-N 0 3 281.444 2.692 20 70 CFIDHN CCOCCCN1CCC[C@@H]1c1ccc2c(c1)OCO2 ZINC000160462124 521706081 /nfs/dbraw/zinc/70/60/81/521706081.db2.gz YAVVPTYMCWWCSN-CQSZACIVSA-N 0 3 277.364 2.979 20 70 CFIDHN COC(CN1CCC(Oc2c(C)cccc2C)CC1)OC ZINC000160606020 522530791 /nfs/dbraw/zinc/53/07/91/522530791.db2.gz ILAUDMQVXLPIDM-UHFFFAOYSA-N 0 3 293.407 2.766 20 70 CFIDHN CC[C@H](NC[C@H]1CN(C2CC2)CCO1)c1ccc(F)cc1 ZINC000160913115 522635443 /nfs/dbraw/zinc/63/54/43/522635443.db2.gz UUZPEEXCRLNKCW-IRXDYDNUSA-N 0 3 292.398 2.730 20 70 CFIDHN CC[C@H](N[C@H](CCO)CSC)c1cccc(OC)c1 ZINC000160198943 522746148 /nfs/dbraw/zinc/74/61/48/522746148.db2.gz VEDPWLQPZNKPEM-HIFRSBDPSA-N 0 3 283.437 2.850 20 70 CFIDHN CC[C@@H](N[C@@H](CCO)CSC)c1cccc(OC)c1 ZINC000160198807 522918966 /nfs/dbraw/zinc/91/89/66/522918966.db2.gz VEDPWLQPZNKPEM-DZGCQCFKSA-N 0 3 283.437 2.850 20 70 CFIDHN CCn1cc([C@@H](C)NC[C@H]2CC(=O)Nc3ccccc32)cn1 ZINC000160645496 523455172 /nfs/dbraw/zinc/45/51/72/523455172.db2.gz GEYKXRFYRQYNKH-CHWSQXEVSA-N 0 3 298.390 2.680 20 70 CFIDHN COc1ccc(CNC[C@@H]2CCC(C)(C)O2)c(OC)c1 ZINC000160288535 524071586 /nfs/dbraw/zinc/07/15/86/524071586.db2.gz NFPFMSZSAACDIX-AWEZNQCLSA-N 0 3 279.380 2.751 20 70 CFIDHN C[C@@H]1CCC[C@H](C(=O)NCCN2CCC[C@H](C)C2)C1 ZINC000160587245 524346098 /nfs/dbraw/zinc/34/60/98/524346098.db2.gz DDTYMFRWJHNQQV-ILXRZTDVSA-N 0 3 266.429 2.661 20 70 CFIDHN CSCC[C@H](C)N(C)Cc1cnc2ccccn12 ZINC000160508097 525564907 /nfs/dbraw/zinc/56/49/07/525564907.db2.gz HDMPGXQJDMWHLS-LBPRGKRZSA-N 0 3 263.410 2.908 20 70 CFIDHN COc1cccc(CCNCc2cn3ccccc3n2)c1 ZINC000218209795 525901523 /nfs/dbraw/zinc/90/15/23/525901523.db2.gz WDRIRXVUXQDMNS-UHFFFAOYSA-N 0 3 281.359 2.675 20 70 CFIDHN CC(C)COC1CCN(CCOCC2CC2)CC1 ZINC000159473416 528080278 /nfs/dbraw/zinc/08/02/78/528080278.db2.gz KEPSMEKMKFPTOK-UHFFFAOYSA-N 0 3 255.402 2.550 20 70 CFIDHN CCN1CCCN(C(=O)NCCC2CCCCC2)CC1 ZINC000159649523 529023603 /nfs/dbraw/zinc/02/36/03/529023603.db2.gz WPIKZEFQMJVRLR-UHFFFAOYSA-N 0 3 281.444 2.694 20 70 CFIDHN CCN1CCCN(C(=O)NC[C@H]2CCC[C@H](C)C2)CC1 ZINC000159742074 529027096 /nfs/dbraw/zinc/02/70/96/529027096.db2.gz OUVMKQHFGNWROG-GJZGRUSLSA-N 0 3 281.444 2.550 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cc(F)cc(F)c1)CC2 ZINC000160456354 282125257 /nfs/dbraw/zinc/12/52/57/282125257.db2.gz CIIWJYHUSVXHPK-LKFCYVNXSA-N 0 3 292.333 2.530 20 70 CFIDHN Fc1cc(F)cc(CNCCN2CCCCCC2)c1 ZINC000159804082 232245668 /nfs/dbraw/zinc/24/56/68/232245668.db2.gz FZGYHYDCRRXEOZ-UHFFFAOYSA-N 0 3 268.351 2.930 20 70 CFIDHN c1ccc(N[C@@H]2CCN(CCOCC3CC3)C2)cc1 ZINC000160277695 232247165 /nfs/dbraw/zinc/24/71/65/232247165.db2.gz RGAWVLYJKBGUBQ-MRXNPFEDSA-N 0 3 260.381 2.599 20 70 CFIDHN Cc1cccc([C@@H](C)C(=O)NCCN2CCC(C)CC2)c1 ZINC000159878654 348015229 /nfs/dbraw/zinc/01/52/29/348015229.db2.gz WVHBBYKJPHXVCA-MRXNPFEDSA-N 0 3 288.435 2.947 20 70 CFIDHN CCCCCNC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000160551616 348018724 /nfs/dbraw/zinc/01/87/24/348018724.db2.gz BGBAEYUMPNVVTL-KBPBESRZSA-N 0 3 252.402 2.557 20 70 CFIDHN CC(C)[C@H]1CCCCN1C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160625267 348018823 /nfs/dbraw/zinc/01/88/23/348018823.db2.gz WQARAVSITYZTDG-HZPDHXFCSA-N 0 3 293.455 2.691 20 70 CFIDHN CCN(C(=O)N[C@@H]1CCN(CC2CC2)C1)[C@H](C)C(C)C ZINC000160758243 348020727 /nfs/dbraw/zinc/02/07/27/348020727.db2.gz MPMATAHIOSAYOW-UKRRQHHQSA-N 0 3 281.444 2.547 20 70 CFIDHN CCc1oc(C(=O)N2CCN(c3ccncc3)CC2)cc1C ZINC000159498810 540996977 /nfs/dbraw/zinc/99/69/77/540996977.db2.gz QGFNPJBWTCKIOH-UHFFFAOYSA-N 0 3 299.374 2.508 20 70 CFIDHN C[C@@H](N[C@@H](CC(N)=O)C1CCCCC1)c1ccccn1 ZINC000159751753 296153008 /nfs/dbraw/zinc/15/30/08/296153008.db2.gz KZDKMIQYLKWEBO-DOMZBBRYSA-N 0 3 275.396 2.557 20 70 CFIDHN CC1(NCc2cnn(Cc3ccccc3)c2)CCC1 ZINC000159917995 378736898 /nfs/dbraw/zinc/73/68/98/378736898.db2.gz QFAKNIHDMRYCCM-UHFFFAOYSA-N 0 3 255.365 2.964 20 70 CFIDHN CC(C)C(=O)N1CCC(NCc2cc(F)cc(F)c2)CC1 ZINC000159918154 378737033 /nfs/dbraw/zinc/73/70/33/378737033.db2.gz AVJUDBXMQQJBPN-UHFFFAOYSA-N 0 3 296.361 2.701 20 70 CFIDHN CC(C)[C@H](O)CNCc1ccc(F)c(C(F)(F)F)c1 ZINC000160150241 378751955 /nfs/dbraw/zinc/75/19/55/378751955.db2.gz OBRZMJJBROKKQH-GFCCVEGCSA-N 0 3 279.277 2.951 20 70 CFIDHN CC[C@H](NCCN(C)CCOC)c1ccc(F)cc1F ZINC000159376124 378705093 /nfs/dbraw/zinc/70/50/93/378705093.db2.gz IGAIOCUFQMCWHS-HNNXBMFYSA-N 0 3 286.366 2.584 20 70 CFIDHN Cc1nnc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)s1 ZINC000160214373 378755741 /nfs/dbraw/zinc/75/57/41/378755741.db2.gz BOVKWURUPULDSO-SMDDNHRTSA-N 0 3 288.420 2.779 20 70 CFIDHN CC[C@H](NC(=O)[C@H]1CCCCN1)c1ccc(F)cc1F ZINC000159725775 378727881 /nfs/dbraw/zinc/72/78/81/378727881.db2.gz MLORBGCQOHISPZ-UONOGXRCSA-N 0 3 282.334 2.674 20 70 CFIDHN CCN(CC)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000159848361 378734337 /nfs/dbraw/zinc/73/43/37/378734337.db2.gz MMDAROKOPLTGSQ-GOEBONIOSA-N 0 3 289.423 2.701 20 70 CFIDHN CSC[C@H](CCO)N[C@H]1CCCOc2ccc(C)cc21 ZINC000160275716 378760426 /nfs/dbraw/zinc/76/04/26/378760426.db2.gz JDKKXKGZPVVZEI-ZFWWWQNUSA-N 0 3 295.448 2.912 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(Cl)s1)CC2 ZINC000160370492 378766225 /nfs/dbraw/zinc/76/62/25/378766225.db2.gz OVDMBGOAHFAPIK-PSASIEDQSA-N 0 3 296.827 2.967 20 70 CFIDHN CCc1nnc(CN[C@H](C)C(C)(C)c2ccccc2)[nH]1 ZINC000160402143 378770408 /nfs/dbraw/zinc/77/04/08/378770408.db2.gz KLTLDBALTOFHHX-GFCCVEGCSA-N 0 3 272.396 2.823 20 70 CFIDHN CCc1nnc(C[NH2+][C@H](C)C(C)(C)c2ccccc2)[n-]1 ZINC000160402143 378770414 /nfs/dbraw/zinc/77/04/14/378770414.db2.gz KLTLDBALTOFHHX-GFCCVEGCSA-N 0 3 272.396 2.823 20 70 CFIDHN O[C@@H]1CCCC[C@H]1NCc1ccc(Cl)cc1F ZINC000160810819 378800671 /nfs/dbraw/zinc/80/06/71/378800671.db2.gz YVQQHUIMEHJUEK-CHWSQXEVSA-N 0 3 257.736 2.872 20 70 CFIDHN Cc1cccc(C)c1CCN[C@@H](C(N)=O)c1ccccc1 ZINC000160615656 378785682 /nfs/dbraw/zinc/78/56/82/378785682.db2.gz BTQVEWLUHUKDOO-QGZVFWFLSA-N 0 3 282.387 2.662 20 70 CFIDHN Cc1nccc(N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)n1 ZINC000160867333 378806334 /nfs/dbraw/zinc/80/63/34/378806334.db2.gz RNZKLYKKNXOYIK-XJKSGUPXSA-N 0 3 282.391 2.860 20 70 CFIDHN Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@H](C)CC(N)=O ZINC000161363505 378841496 /nfs/dbraw/zinc/84/14/96/378841496.db2.gz WHXBZOLHGYQJBW-RKDXNWHRSA-N 0 3 283.441 2.664 20 70 CFIDHN CC[C@@H](NCCOCCO)c1cccc(Cl)c1F ZINC000161507697 378853055 /nfs/dbraw/zinc/85/30/55/378853055.db2.gz HHGJSCUGIPNISF-GFCCVEGCSA-N 0 3 275.751 2.529 20 70 CFIDHN Cc1cccc(OCCN(C)C[C@@H](O)Cc2ccccc2)c1 ZINC000218763797 393758472 /nfs/dbraw/zinc/75/84/72/393758472.db2.gz NFFRCLXXYQUTLR-SFHVURJKSA-N 0 3 299.414 2.909 20 70 CFIDHN Cc1ccc(OCCN(C)C[C@@H](O)Cc2ccccc2)cc1 ZINC000218763292 393758590 /nfs/dbraw/zinc/75/85/90/393758590.db2.gz YFDPYQCUICPBTQ-SFHVURJKSA-N 0 3 299.414 2.909 20 70 CFIDHN C[C@H]1C[C@@H](NCCO)c2cccc(Br)c21 ZINC000159707141 394365559 /nfs/dbraw/zinc/36/55/59/394365559.db2.gz QTXGXCJEDOVNNH-GZMMTYOYSA-N 0 3 270.170 2.579 20 70 CFIDHN CC[C@@H]1CCCC[C@@H]1NC(=O)N1CCCN(CC)CC1 ZINC000159683731 394365736 /nfs/dbraw/zinc/36/57/36/394365736.db2.gz AZYBOBZZGIEEOF-CABCVRRESA-N 0 3 281.444 2.692 20 70 CFIDHN CC(C)C[C@@H](CN(C)C)NC(=O)N1CCC2(CCC2)C1 ZINC000160812873 394366824 /nfs/dbraw/zinc/36/68/24/394366824.db2.gz KLLMYVLPETZZCU-AWEZNQCLSA-N 0 3 281.444 2.548 20 70 CFIDHN CS[C@H](C)CC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000161378052 286711532 /nfs/dbraw/zinc/71/15/32/286711532.db2.gz HLDNGRBEEZUZJQ-HIFRSBDPSA-N 0 3 294.464 2.856 20 70 CFIDHN CC(C)(N)C(=O)NCC(C)(C)CCCc1ccccc1 ZINC000160121853 264238903 /nfs/dbraw/zinc/23/89/03/264238903.db2.gz MVYVOPNNJLIOQP-UHFFFAOYSA-N 0 3 276.424 2.889 20 70 CFIDHN COc1ccc2c(c1)C[C@H](NCc1ccoc1)CC2 ZINC000159553468 274127876 /nfs/dbraw/zinc/12/78/76/274127876.db2.gz IDUBTNLLGUGBAI-OAHLLOKOSA-N 0 3 257.333 2.935 20 70 CFIDHN C[C@@H]1CN(C)CC[C@@H]1N(C)c1nc2cc(F)ccc2o1 ZINC000160426129 274334820 /nfs/dbraw/zinc/33/48/20/274334820.db2.gz HUGDUHCZGZGNIQ-MFKMUULPSA-N 0 3 277.343 2.743 20 70 CFIDHN CC(C)[C@H](N)C(=O)N1CCCC2(CCCCC2)C1 ZINC000159859245 277902926 /nfs/dbraw/zinc/90/29/26/277902926.db2.gz AFPSGWILHLVYDO-ZDUSSCGKSA-N 0 3 252.402 2.543 20 70 CFIDHN C[C@H]1C[C@@H](NCCc2ncn(C)n2)c2ccsc2S1 ZINC000217003362 279967334 /nfs/dbraw/zinc/96/73/34/279967334.db2.gz IXDMWHYLHLLUHK-GXSJLCMTSA-N 0 3 294.449 2.634 20 70 CFIDHN COC[C@H](Cc1ccccc1)N[C@H](CCO)c1ccccc1 ZINC000161027838 293115594 /nfs/dbraw/zinc/11/55/94/293115594.db2.gz WXTSOAKELPQGMU-RBUKOAKNSA-N 0 3 299.414 2.957 20 70 CFIDHN Cc1cc(C)c2c(c1)[C@H](NCC(C)(C)O)CCCO2 ZINC000160640648 301211460 /nfs/dbraw/zinc/21/14/60/301211460.db2.gz UFLYKAYNPWMMTR-CQSZACIVSA-N 0 3 263.381 2.878 20 70 CFIDHN CC[C@@H](OC1CCCCC1)C(=O)NC[C@@H]1CCCN1CC ZINC000159578570 322324453 /nfs/dbraw/zinc/32/44/53/322324453.db2.gz MEZQOEXTHCUHFE-GOEBONIOSA-N 0 3 296.455 2.715 20 70 CFIDHN CC[C@H](OC1CCCCC1)C(=O)NC[C@H]1CCCN1CC ZINC000159578709 322324804 /nfs/dbraw/zinc/32/48/04/322324804.db2.gz MEZQOEXTHCUHFE-ZBFHGGJFSA-N 0 3 296.455 2.715 20 70 CFIDHN Cc1cnc([C@H](NCCC(C)(C)O)C2CC2)s1 ZINC000159703771 322326984 /nfs/dbraw/zinc/32/69/84/322326984.db2.gz MOTGSRVODBYYTN-LLVKDONJSA-N 0 3 254.399 2.653 20 70 CFIDHN Cc1cc(C)c(C(=O)N[C@H](CN(C)C)c2ccccc2)[nH]1 ZINC000159844420 322329454 /nfs/dbraw/zinc/32/94/54/322329454.db2.gz AXHTXJBSHSGPKN-OAHLLOKOSA-N 0 3 285.391 2.664 20 70 CFIDHN CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)[C@H](C)N ZINC000160078143 322332537 /nfs/dbraw/zinc/33/25/37/322332537.db2.gz ATIKFGGYBGUORR-GWCFXTLKSA-N 0 3 268.788 2.843 20 70 CFIDHN CCc1ncc(C(=O)NC[C@H]2CCCN2CC(C)C)s1 ZINC000160405351 322337545 /nfs/dbraw/zinc/33/75/45/322337545.db2.gz NDGATVGAEWUAFD-GFCCVEGCSA-N 0 3 295.452 2.556 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)C1CCCCCC1 ZINC000160611764 322340552 /nfs/dbraw/zinc/34/05/52/322340552.db2.gz RBKSXOPNISMHJM-UHFFFAOYSA-N 0 3 275.458 2.854 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@@H]1CCCC[C@H]1C ZINC000160756407 322342299 /nfs/dbraw/zinc/34/22/99/322342299.db2.gz WCHGHBCJHXZRRT-ZIAGYGMSSA-N 0 3 275.458 2.710 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@@H]1CCC[C@@H](C)C1 ZINC000160795355 322342755 /nfs/dbraw/zinc/34/27/55/322342755.db2.gz JWLSDGDIUFPGND-ZIAGYGMSSA-N 0 3 275.458 2.710 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC[C@@H]([C@@H](C)O)C2)cc1 ZINC000160934197 322345523 /nfs/dbraw/zinc/34/55/23/322345523.db2.gz HNVIHCQVDGLBDD-GDBMZVCRSA-N 0 3 275.392 2.661 20 70 CFIDHN CC(C)n1cc([C@@H](C)NC[C@H]2CCCC[C@@H]2O)cn1 ZINC000160621845 519976685 /nfs/dbraw/zinc/97/66/85/519976685.db2.gz WLCGBAWUJVQHCL-NFAWXSAZSA-N 0 3 265.401 2.666 20 70 CFIDHN COc1cc(CNCc2cccc3cc[nH]c32)ccn1 ZINC000218099624 522468049 /nfs/dbraw/zinc/46/80/49/522468049.db2.gz ZBDGEOYZDAMKBQ-UHFFFAOYSA-N 0 3 267.332 2.861 20 70 CFIDHN CC[C@@H](NC[C@@H]1CN(C2CC2)CCO1)c1ccc(F)cc1 ZINC000160912992 522856981 /nfs/dbraw/zinc/85/69/81/522856981.db2.gz UUZPEEXCRLNKCW-IAGOWNOFSA-N 0 3 292.398 2.730 20 70 CFIDHN CCn1cc([C@@H](C)NC[C@@H]2CC(=O)Nc3ccccc32)cn1 ZINC000160645323 523454251 /nfs/dbraw/zinc/45/42/51/523454251.db2.gz GEYKXRFYRQYNKH-OLZOCXBDSA-N 0 3 298.390 2.680 20 70 CFIDHN Cc1ccc(C)c([C@H](C)NCCNC(=O)c2ccco2)c1 ZINC000160712351 524210071 /nfs/dbraw/zinc/21/00/71/524210071.db2.gz SYVZSYZYCGUMBI-AWEZNQCLSA-N 0 3 286.375 2.977 20 70 CFIDHN Cc1ccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 ZINC000161406845 524449456 /nfs/dbraw/zinc/44/94/56/524449456.db2.gz UZRBWCNFZGRNCR-MRXNPFEDSA-N 0 3 296.418 2.912 20 70 CFIDHN C[C@@H](CNC(=O)N1CCC2(CCC2)C1)N1CCC[C@@H](C)C1 ZINC000160268995 524664133 /nfs/dbraw/zinc/66/41/33/524664133.db2.gz XDAJIIAQWNZBCC-CABCVRRESA-N 0 3 293.455 2.692 20 70 CFIDHN CSC[C@@H](CCO)N[C@H](CC(C)C)c1ccccn1 ZINC000160174681 525641314 /nfs/dbraw/zinc/64/13/14/525641314.db2.gz FNIWMZPUYDTAGX-UKRRQHHQSA-N 0 3 282.453 2.872 20 70 CFIDHN Cc1c2cc(C)ccc2[nH]c1C(=O)N(C)[C@@H]1CCCN(C)C1 ZINC000159917682 525944595 /nfs/dbraw/zinc/94/45/95/525944595.db2.gz BHFXCWKVZDBGFI-CQSZACIVSA-N 0 3 299.418 2.951 20 70 CFIDHN NC(=O)C1CCC(NCc2ccc(Cl)cc2F)CC1 ZINC000160762552 526855529 /nfs/dbraw/zinc/85/55/29/526855529.db2.gz BMDRTWCDWSNSHV-UHFFFAOYSA-N 0 3 284.762 2.613 20 70 CFIDHN OCC1(CNCc2ccccc2OC(F)F)CCCC1 ZINC000160095309 527524556 /nfs/dbraw/zinc/52/45/56/527524556.db2.gz VIFGLTBIVHFSAW-UHFFFAOYSA-N 0 3 285.334 2.930 20 70 CFIDHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CCCC1(C)C ZINC000159486684 528898646 /nfs/dbraw/zinc/89/86/46/528898646.db2.gz GYTOWGXIEZNZEK-ZDUSSCGKSA-N 0 3 269.433 2.547 20 70 CFIDHN CC(C)N(CCc1nccs1)C[C@H]1CCCCO1 ZINC000159787788 528916890 /nfs/dbraw/zinc/91/68/90/528916890.db2.gz SBULKHSFMJGETL-CYBMUJFWSA-N 0 3 268.426 2.965 20 70 CFIDHN CCCCc1ccc([C@H](C)N[C@H](C)CC(N)=O)cc1 ZINC000161359515 529028585 /nfs/dbraw/zinc/02/85/85/529028585.db2.gz JRHKFPYIDJDOMM-OLZOCXBDSA-N 0 3 262.397 2.944 20 70 CFIDHN CC[C@@H](C)C[C@H](C)NC(=O)N1CCCN(CC)CC1 ZINC000159920192 529336062 /nfs/dbraw/zinc/33/60/62/529336062.db2.gz YATOMHLFGCRKBE-KGLIPLIRSA-N 0 3 269.433 2.548 20 70 CFIDHN CC[C@H](C)N(C)CCN[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000160122424 529690494 /nfs/dbraw/zinc/69/04/94/529690494.db2.gz QBGTYKBDCBQRHM-PJSUUKDQSA-N 0 3 296.480 2.805 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)N1CCc2ccccc2C1 ZINC000159680601 348014386 /nfs/dbraw/zinc/01/43/86/348014386.db2.gz BFSGGJVLLIUYFG-WMZOPIPTSA-N 0 3 298.430 2.836 20 70 CFIDHN Cc1ccsc1CNC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159728015 348014543 /nfs/dbraw/zinc/01/45/43/348014543.db2.gz POLRMVDAMOZQTN-KBPBESRZSA-N 0 3 292.448 2.937 20 70 CFIDHN Cc1cccc([C@H](C)C(=O)NCCN2CCC(C)CC2)c1 ZINC000159878790 348015160 /nfs/dbraw/zinc/01/51/60/348015160.db2.gz WVHBBYKJPHXVCA-INIZCTEOSA-N 0 3 288.435 2.947 20 70 CFIDHN CN(Cc1cccs1)C(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000160548622 348019063 /nfs/dbraw/zinc/01/90/63/348019063.db2.gz WCQKAJXOAAWAHC-ZFWWWQNUSA-N 0 3 292.448 2.971 20 70 CFIDHN CCCOc1ccc([C@H](C)NCCO)c(OCCC)c1 ZINC000159705235 188438353 /nfs/dbraw/zinc/43/83/53/188438353.db2.gz SNZSCEMLDAPUME-ZDUSSCGKSA-N 0 3 281.396 2.907 20 70 CFIDHN CCCCN(C)CCNC(=O)Nc1ccnc(C)c1Cl ZINC000159740876 541011465 /nfs/dbraw/zinc/01/14/65/541011465.db2.gz UQVHREJSDNATDC-UHFFFAOYSA-N 0 3 298.818 2.897 20 70 CFIDHN CCn1nccc1CN[C@H]1CCCN(Cc2ccccc2)C1 ZINC000159977105 541019475 /nfs/dbraw/zinc/01/94/75/541019475.db2.gz NDFJZSILXOHXQW-KRWDZBQOSA-N 0 3 298.434 2.657 20 70 CFIDHN CC1(O)CCN(Cc2cc(F)cc3cccnc32)CC1 ZINC000161232089 541563334 /nfs/dbraw/zinc/56/33/34/541563334.db2.gz XKVHHNUJCPXCJT-UHFFFAOYSA-N 0 3 274.339 2.721 20 70 CFIDHN CC(C)C[C@@H](NCCCN1CCCC1=O)c1ccccn1 ZINC000159476181 378712291 /nfs/dbraw/zinc/71/22/91/378712291.db2.gz PNSHEXIIGLLMIC-MRXNPFEDSA-N 0 3 289.423 2.771 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H](C)c2ccccc2C)CC1 ZINC000159505006 378714331 /nfs/dbraw/zinc/71/43/31/378714331.db2.gz XIBFIEIWFBMRKI-OAHLLOKOSA-N 0 3 289.423 2.793 20 70 CFIDHN Cc1c2ccccc2oc1[C@H](NC(=O)[C@H](C)N)C(C)C ZINC000159695762 378724332 /nfs/dbraw/zinc/72/43/32/378724332.db2.gz HEVHRLACGVYTRY-SMDDNHRTSA-N 0 3 274.364 2.902 20 70 CFIDHN c1coc(CN(CCn2ccnc2)C2CCCC2)c1 ZINC000159760761 378729247 /nfs/dbraw/zinc/72/92/47/378729247.db2.gz YNIJMNKTEBTSJL-UHFFFAOYSA-N 0 3 259.353 2.921 20 70 CFIDHN CCOC(=O)CCCN(C)Cc1cccc(N(C)C)c1 ZINC000159809442 378731948 /nfs/dbraw/zinc/73/19/48/378731948.db2.gz LYHPFFLUYQJNQI-UHFFFAOYSA-N 0 3 278.396 2.528 20 70 CFIDHN CC(C)[C@@H](N)C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000159813084 378732467 /nfs/dbraw/zinc/73/24/67/378732467.db2.gz NOQQKEZABVNVPM-TZMCWYRMSA-N 0 3 280.799 2.639 20 70 CFIDHN O=C([C@@H]1CCCCN1)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000159805675 378732741 /nfs/dbraw/zinc/73/27/41/378732741.db2.gz JCUCUVITYKVDOO-HIFRSBDPSA-N 0 3 292.810 2.798 20 70 CFIDHN CCc1nc(C)c([C@H](C)N(C)CCn2ccnc2)s1 ZINC000159848808 378734287 /nfs/dbraw/zinc/73/42/87/378734287.db2.gz UNQRAAKSMLUGFD-LBPRGKRZSA-N 0 3 278.425 2.903 20 70 CFIDHN COCCN(Cc1ccn(C)c1)Cc1ccccc1 ZINC000160444145 378772315 /nfs/dbraw/zinc/77/23/15/378772315.db2.gz GKOSHJRKUHMDDG-UHFFFAOYSA-N 0 3 258.365 2.674 20 70 CFIDHN CC(=O)Nc1ccccc1CNC[C@H](O)c1ccsc1 ZINC000160474706 378775909 /nfs/dbraw/zinc/77/59/09/378775909.db2.gz OMLHNSZZJPBZFV-HNNXBMFYSA-N 0 3 290.388 2.530 20 70 CFIDHN Cc1ccc([C@H](C)NCC(=O)NCC(F)(F)F)cc1C ZINC000160557947 378781307 /nfs/dbraw/zinc/78/13/07/378781307.db2.gz GROSXGPCVGQTEZ-NSHDSACASA-N 0 3 288.313 2.633 20 70 CFIDHN CCc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)s1 ZINC000160559345 378782458 /nfs/dbraw/zinc/78/24/58/378782458.db2.gz XGBVGMAGNYDWBC-ZYHUDNBSSA-N 0 3 290.436 2.876 20 70 CFIDHN CC[C@H](C)CN(CC)[C@H](C(N)=O)c1ccc(F)cc1 ZINC000160583660 378784298 /nfs/dbraw/zinc/78/42/98/378784298.db2.gz DLBRFPNKDLQGCS-FZMZJTMJSA-N 0 3 266.360 2.720 20 70 CFIDHN Cc1csc(CCCCN[C@H](C)c2cnccn2)n1 ZINC000160668521 378789139 /nfs/dbraw/zinc/78/91/39/378789139.db2.gz ZJYSTHLEVKYHMG-GFCCVEGCSA-N 0 3 276.409 2.915 20 70 CFIDHN CC[C@@H](NCCCNC(C)=O)c1ccc(F)cc1F ZINC000160718558 378792792 /nfs/dbraw/zinc/79/27/92/378792792.db2.gz OOKNRRXKNHZTPV-CQSZACIVSA-N 0 3 270.323 2.532 20 70 CFIDHN CC[C@@H](NC(=O)[C@H](N)C(C)C)c1ccc(F)cc1F ZINC000161209937 378830913 /nfs/dbraw/zinc/83/09/13/378830913.db2.gz BGFKKJSQVLRMIO-CHWSQXEVSA-N 0 3 270.323 2.515 20 70 CFIDHN NC1(C(=O)N[C@@H](Cc2ccccc2)C2CC2)CCCCC1 ZINC000161260234 378834660 /nfs/dbraw/zinc/83/46/60/378834660.db2.gz DRTICUFCOFZUCA-INIZCTEOSA-N 0 3 286.419 2.786 20 70 CFIDHN C[C@@H](CN[C@@H](C)c1cnn(C)c1)N(C)Cc1ccccc1 ZINC000160866182 378806152 /nfs/dbraw/zinc/80/61/52/378806152.db2.gz WMGHNYFKUHKADC-GJZGRUSLSA-N 0 3 286.423 2.591 20 70 CFIDHN C[C@H](CN1CCCC1=O)NCc1cc(F)cc(Cl)c1 ZINC000160901866 378807190 /nfs/dbraw/zinc/80/71/90/378807190.db2.gz UNAAEJYTWBYYKD-SNVBAGLBSA-N 0 3 284.762 2.580 20 70 CFIDHN CCN1CCCC[C@H]1CN[C@@H](C)c1cnc(C)nc1C ZINC000161174520 378827773 /nfs/dbraw/zinc/82/77/73/378827773.db2.gz MJFNJYCLNIBFES-WFASDCNBSA-N 0 3 276.428 2.618 20 70 CFIDHN CSc1cc(C(=O)NC[C@@H](C)N(C)C2CC2)ccc1F ZINC000161312388 378839301 /nfs/dbraw/zinc/83/93/01/378839301.db2.gz RIYDWHQXCFUKGL-SNVBAGLBSA-N 0 3 296.411 2.760 20 70 CFIDHN C[C@@H](NCC1(c2ccc(F)cc2)CC1)c1cnccn1 ZINC000161360015 378841557 /nfs/dbraw/zinc/84/15/57/378841557.db2.gz FZQOVMGBVBHGAP-GFCCVEGCSA-N 0 3 271.339 2.998 20 70 CFIDHN CC(C)C[C@H](N)C(=O)NC[C@H](C)Oc1cccc(Cl)c1 ZINC000161403016 378844448 /nfs/dbraw/zinc/84/44/48/378844448.db2.gz FESLBNGERRIKFR-FZMZJTMJSA-N 0 3 298.814 2.597 20 70 CFIDHN Cc1nn(C)cc1CNC1(c2ccccc2)CCC1 ZINC000161406635 378844601 /nfs/dbraw/zinc/84/46/01/378844601.db2.gz XFSZATHRXITXSV-UHFFFAOYSA-N 0 3 255.365 2.898 20 70 CFIDHN C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](N)C(C)(C)C ZINC000161421366 378846675 /nfs/dbraw/zinc/84/66/75/378846675.db2.gz POXOXIYPCFAEPZ-VHDGCEQUSA-N 0 3 274.408 2.764 20 70 CFIDHN Cc1cc(CNCCNC(=O)OC(C)(C)C)cc(C)c1O ZINC000218178989 382789286 /nfs/dbraw/zinc/78/92/86/382789286.db2.gz KEUXICBYAJHGSB-UHFFFAOYSA-N 0 3 294.395 2.623 20 70 CFIDHN C[C@@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccccc1 ZINC000218461129 382790295 /nfs/dbraw/zinc/79/02/95/382790295.db2.gz HKPUMDHSXFAMIP-UKRRQHHQSA-N 0 3 281.421 2.629 20 70 CFIDHN CO[C@]1(C)C[C@H](NCc2ccccc2NC(C)=O)C1(C)C ZINC000160511777 394366569 /nfs/dbraw/zinc/36/65/69/394366569.db2.gz CODOOPPEMDYLKN-DOTOQJQBSA-N 0 3 290.407 2.938 20 70 CFIDHN COc1c(C)cnc(CN(C[C@H]2CCOC2)C2CC2)c1C ZINC000160968908 394366959 /nfs/dbraw/zinc/36/69/59/394366959.db2.gz KEAJYEKJJDYCPQ-CQSZACIVSA-N 0 3 290.407 2.708 20 70 CFIDHN Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)[C@@H](C)N)cc1 ZINC000161234896 292280352 /nfs/dbraw/zinc/28/03/52/292280352.db2.gz AURGJYPCEQUJAM-UMVBOHGHSA-N 0 3 260.381 2.642 20 70 CFIDHN CCc1nsc(N2CCC[C@@H]2CN2CCCCC2)n1 ZINC000160443584 276705880 /nfs/dbraw/zinc/70/58/80/276705880.db2.gz QTRLCDRLFZVJBK-GFCCVEGCSA-N 0 3 280.441 2.555 20 70 CFIDHN COc1ccc2c(c1)CCC[C@@H]2NCc1cnn(C)c1C ZINC000161313046 277948172 /nfs/dbraw/zinc/94/81/72/277948172.db2.gz NEDBEJVXFLZOEV-KRWDZBQOSA-N 0 3 285.391 2.904 20 70 CFIDHN CCCN(CCN(C)C)C(=O)c1oc(CC)cc1C ZINC000159394906 322322266 /nfs/dbraw/zinc/32/22/66/322322266.db2.gz NVZFEDPCQPNQFU-UHFFFAOYSA-N 0 3 266.385 2.564 20 70 CFIDHN CCOc1ccccc1[C@@H](C)NCCCN1CCCC1=O ZINC000159564363 322324717 /nfs/dbraw/zinc/32/47/17/322324717.db2.gz RUONYFWEBDDSCM-CQSZACIVSA-N 0 3 290.407 2.748 20 70 CFIDHN Cc1ccccc1CNC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159614868 322325387 /nfs/dbraw/zinc/32/53/87/322325387.db2.gz QUVGUCXNJWENKX-RDJZCZTQSA-N 0 3 286.419 2.876 20 70 CFIDHN CC1(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC1 ZINC000159664057 322326185 /nfs/dbraw/zinc/32/61/85/322326185.db2.gz MYVZFYXINULQEH-HNNXBMFYSA-N 0 3 272.392 2.740 20 70 CFIDHN CCC[C@H](N)C(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000159802093 322328757 /nfs/dbraw/zinc/32/87/57/322328757.db2.gz WIMMXEFVHFIKIJ-LBPRGKRZSA-N 0 3 266.772 2.573 20 70 CFIDHN C[C@H](CN[C@H](C)c1cnccn1)N1CCc2ccccc2C1 ZINC000159807233 322328777 /nfs/dbraw/zinc/32/87/77/322328777.db2.gz CGSUFVRILURWSX-HUUCEWRRSA-N 0 3 296.418 2.574 20 70 CFIDHN CC(C)C(=O)NCCCN[C@H](C)c1ccccc1F ZINC000159991257 322331528 /nfs/dbraw/zinc/33/15/28/322331528.db2.gz ZULVXPYIIGBWAB-GFCCVEGCSA-N 0 3 266.360 2.639 20 70 CFIDHN Cc1ccc([C@@H](CNC(=O)NC2(C)CCC2)N(C)C)cc1 ZINC000160213079 322334626 /nfs/dbraw/zinc/33/46/26/322334626.db2.gz TYIOSIPSNUIXGI-OAHLLOKOSA-N 0 3 289.423 2.840 20 70 CFIDHN CCSCC[C@@H](C)NC(=O)[C@H]1CNCc2ccccc21 ZINC000160208847 322334798 /nfs/dbraw/zinc/33/47/98/322334798.db2.gz WDXYFKKIUWLOSN-DOMZBBRYSA-N 0 3 292.448 2.521 20 70 CFIDHN C[C@@H]1C[C@H](NC(=O)C2CCC(C)(C)CC2)CN1C1CC1 ZINC000161105413 322347446 /nfs/dbraw/zinc/34/74/46/322347446.db2.gz QTGLZDHKLQFNKF-OCCSQVGLSA-N 0 3 278.440 2.944 20 70 CFIDHN C[C@H]1C[C@H](NC(=O)C2CCC(C)(C)CC2)CN1C1CC1 ZINC000161105519 322347635 /nfs/dbraw/zinc/34/76/35/322347635.db2.gz QTGLZDHKLQFNKF-JSGCOSHPSA-N 0 3 278.440 2.944 20 70 CFIDHN CC[C@H](N)C(=O)Nc1ccccc1SC(C)C ZINC000161398370 322351021 /nfs/dbraw/zinc/35/10/21/322351021.db2.gz QSBZTEAMSHZSBD-JTQLQIEISA-N 0 3 252.383 2.863 20 70 CFIDHN CC(C)CN1CCN(Cc2csc(C3CC3)n2)CC1 ZINC000161314381 519727019 /nfs/dbraw/zinc/72/70/19/519727019.db2.gz YVOGENPGEFTXCZ-UHFFFAOYSA-N 0 3 279.453 2.794 20 70 CFIDHN CCCN1CCCN(C(=O)CCC2CCCC2)CC1 ZINC000160364566 519848941 /nfs/dbraw/zinc/84/89/41/519848941.db2.gz ORKQOZUTWQTWJQ-UHFFFAOYSA-N 0 3 266.429 2.901 20 70 CFIDHN CCCN1CCCN(C(=O)c2cc(C)ccc2C)CC1 ZINC000160383263 519850751 /nfs/dbraw/zinc/85/07/51/519850751.db2.gz HEGZGVYTVUHTEO-UHFFFAOYSA-N 0 3 274.408 2.861 20 70 CFIDHN CCOC(=O)CCCN1CCC[C@@H]1c1cccc(C)n1 ZINC000159842700 520640902 /nfs/dbraw/zinc/64/09/02/520640902.db2.gz SRJPWMWQYZRYGX-OAHLLOKOSA-N 0 3 276.380 2.870 20 70 CFIDHN CCC(=O)N1CCCN(CCC2CCCC2)CC1 ZINC000159467727 521105209 /nfs/dbraw/zinc/10/52/09/521105209.db2.gz NCCSQXBQONGRJT-UHFFFAOYSA-N 0 3 252.402 2.511 20 70 CFIDHN CCOc1ccc([C@H](C)N[C@H](CCO)CSC)cc1 ZINC000160404214 521260835 /nfs/dbraw/zinc/26/08/35/521260835.db2.gz GARFCEFOFIUSCH-GXTWGEPZSA-N 0 3 283.437 2.850 20 70 CFIDHN CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1CC1(C)C ZINC000160941310 521751018 /nfs/dbraw/zinc/75/10/18/521751018.db2.gz QAQMRFVRTBXSSH-AWEZNQCLSA-N 0 3 292.398 2.762 20 70 CFIDHN COC[C@@H](C)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161149547 522253724 /nfs/dbraw/zinc/25/37/24/522253724.db2.gz GIHYPISAXFJKKU-BDJLRTHQSA-N 0 3 277.364 2.533 20 70 CFIDHN COc1cc(CNC(C)(C)[C@H](C)O)cc(Cl)c1OC ZINC000161122434 522438856 /nfs/dbraw/zinc/43/88/56/522438856.db2.gz LZVBKHPIWQOKHI-VIFPVBQESA-N 0 3 287.787 2.606 20 70 CFIDHN CN(CCCC(=O)c1ccc(F)cc1)[C@@H]1CCOC1 ZINC000160035395 522724010 /nfs/dbraw/zinc/72/40/10/522724010.db2.gz VWNDWAKHYXXMEV-CQSZACIVSA-N 0 3 265.328 2.509 20 70 CFIDHN CN(CCCC(=O)c1ccc(F)cc1)[C@H]1CCOC1 ZINC000160035507 522725502 /nfs/dbraw/zinc/72/55/02/522725502.db2.gz VWNDWAKHYXXMEV-AWEZNQCLSA-N 0 3 265.328 2.509 20 70 CFIDHN CN1CCC(Oc2ccc(NCc3ccco3)cn2)CC1 ZINC000160085074 523783089 /nfs/dbraw/zinc/78/30/89/523783089.db2.gz KKRJTTKUFIGTNQ-UHFFFAOYSA-N 0 3 287.363 2.760 20 70 CFIDHN CCc1ccc(CC(=O)N[C@H](C)CN2CCCCC2)cc1 ZINC000160360396 523909923 /nfs/dbraw/zinc/90/99/23/523909923.db2.gz QQUJZJLHBZHNRV-OAHLLOKOSA-N 0 3 288.435 2.782 20 70 CFIDHN CN1CCN(Cc2cnc3ccccn23)C2(CCCCC2)C1 ZINC000160896937 523913673 /nfs/dbraw/zinc/91/36/73/523913673.db2.gz PMSPBSRKZZOFRD-UHFFFAOYSA-N 0 3 298.434 2.785 20 70 CFIDHN Cc1cc(CNCCc2cccc3cccnc32)n(C)n1 ZINC000159407914 524755818 /nfs/dbraw/zinc/75/58/18/524755818.db2.gz QGYGAJQTTMEFDC-UHFFFAOYSA-N 0 3 280.375 2.609 20 70 CFIDHN Cc1cccc([C@@H](C)C(=O)NCCN2CCCCC2)c1 ZINC000159892003 524815125 /nfs/dbraw/zinc/81/51/25/524815125.db2.gz YPIYWGQUKVDMAJ-OAHLLOKOSA-N 0 3 274.408 2.701 20 70 CFIDHN Cc1cccc([C@@H](C)CNC(=O)[C@@H](N)CC(C)C)c1 ZINC000160738173 524819753 /nfs/dbraw/zinc/81/97/53/524819753.db2.gz KCMHFOKCLFCNNJ-ZFWWWQNUSA-N 0 3 262.397 2.588 20 70 CFIDHN C[C@H](NC[C@H]1CC(=O)Nc2ccccc21)c1cncc(F)c1 ZINC000160682242 525411870 /nfs/dbraw/zinc/41/18/70/525411870.db2.gz HNAPIQNQNGUGHD-WCQYABFASA-N 0 3 299.349 2.997 20 70 CFIDHN c1cc([C@@H]2CCCN2CCOCC2CC2)cc2c1OCO2 ZINC000160460117 526435883 /nfs/dbraw/zinc/43/58/83/526435883.db2.gz HNTNWVSUOKNURF-HNNXBMFYSA-N 0 3 289.375 2.979 20 70 CFIDHN Cc1nc2ccccn2c1CN1CCC(n2ccnc2)CC1 ZINC000160330303 527178074 /nfs/dbraw/zinc/17/80/74/527178074.db2.gz LRRTXQPKEXLIBY-UHFFFAOYSA-N 0 3 295.390 2.676 20 70 CFIDHN CC(C)N(CCOCC(F)(F)F)CCc1nccs1 ZINC000159748743 528911173 /nfs/dbraw/zinc/91/11/73/528911173.db2.gz JRHBNSGMSYGJHE-UHFFFAOYSA-N 0 3 296.358 2.975 20 70 CFIDHN CC(C)[C@H](CC1CCCC1)C(=O)N1CCCNCC1 ZINC000160843700 528980634 /nfs/dbraw/zinc/98/06/34/528980634.db2.gz ACTNBTMPOJEZTJ-HNNXBMFYSA-N 0 3 266.429 2.661 20 70 CFIDHN CC[C@@H]1CCC[C@@H](NC(=O)N2CCCN(CC)CC2)C1 ZINC000159894628 529303881 /nfs/dbraw/zinc/30/38/81/529303881.db2.gz WEJCGXJPTVUPAK-HUUCEWRRSA-N 0 3 281.444 2.692 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](CC(C)C)c1ccccn1)CC2 ZINC000160324065 282119155 /nfs/dbraw/zinc/11/91/55/282119155.db2.gz YWJSOMDVLDJQSG-GOEBONIOSA-N 0 3 299.422 2.673 20 70 CFIDHN CCSCC[C@H](C)NC(=O)c1cccc2c1CCNC2 ZINC000160217480 348017114 /nfs/dbraw/zinc/01/71/14/348017114.db2.gz JVXSQZWQVJQFIJ-LBPRGKRZSA-N 0 3 292.448 2.594 20 70 CFIDHN CCCn1nccc1CNCCCN(C)c1ccccc1 ZINC000159958350 540665817 /nfs/dbraw/zinc/66/58/17/540665817.db2.gz ZVUDDIXUKOEBJC-UHFFFAOYSA-N 0 3 286.423 2.909 20 70 CFIDHN CCCn1nccc1CNCCOC1CCCCC1 ZINC000160147795 540669139 /nfs/dbraw/zinc/66/91/39/540669139.db2.gz TXMYITVNWNMKQS-UHFFFAOYSA-N 0 3 265.401 2.732 20 70 CFIDHN CCCn1nccc1CNCCc1cc(F)cc(F)c1 ZINC000160136735 540669398 /nfs/dbraw/zinc/66/93/98/540669398.db2.gz FXHNNBNMANNLGT-UHFFFAOYSA-N 0 3 279.334 2.904 20 70 CFIDHN CCC(CC)c1cc(CNC(=O)[C@H](N)CC(C)C)on1 ZINC000161108466 540688495 /nfs/dbraw/zinc/68/84/95/540688495.db2.gz KUTZSASVAVLJAN-CYBMUJFWSA-N 0 3 281.400 2.568 20 70 CFIDHN CCN1CCCC[C@@H]1CNC(=O)C[C@@H](C)c1ccncc1 ZINC000160251766 541410078 /nfs/dbraw/zinc/41/00/78/541410078.db2.gz VBXGYGUEBPYLRO-GDBMZVCRSA-N 0 3 289.423 2.566 20 70 CFIDHN CC1(C)C[C@@H](NCc2ccn(-c3ccccc3)n2)CCO1 ZINC000159993419 378742345 /nfs/dbraw/zinc/74/23/45/378742345.db2.gz XJEZQBJFYQTYAN-AWEZNQCLSA-N 0 3 285.391 2.920 20 70 CFIDHN CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)[C@@H]1CCOC1 ZINC000160066622 378746911 /nfs/dbraw/zinc/74/69/11/378746911.db2.gz NLYCVRJDHNCLNH-OAHLLOKOSA-N 0 3 291.391 2.863 20 70 CFIDHN COC[C@@H](NCc1ccc(OC(C)C)nc1)C(C)C ZINC000160088434 378747186 /nfs/dbraw/zinc/74/71/86/378747186.db2.gz ZNSUQHGQMBYTTE-CQSZACIVSA-N 0 3 266.385 2.629 20 70 CFIDHN CCC[C@@H](N)C(=O)N1CCC[C@@](C)(c2ccccc2)C1 ZINC000160104564 378748214 /nfs/dbraw/zinc/74/82/14/378748214.db2.gz IBZDURDEMMPUNE-NVXWUHKLSA-N 0 3 274.408 2.694 20 70 CFIDHN CCN(CCNC(=O)c1ccc(F)c(SC)c1)C1CC1 ZINC000160148354 378751623 /nfs/dbraw/zinc/75/16/23/378751623.db2.gz QRGYSHDMCLNYDP-UHFFFAOYSA-N 0 3 296.411 2.762 20 70 CFIDHN CCCC[C@H](COC)NCc1cccc(C(=O)NCC)c1 ZINC000160186373 378753528 /nfs/dbraw/zinc/75/35/28/378753528.db2.gz HJTAFKWXPVKFTG-MRXNPFEDSA-N 0 3 292.423 2.731 20 70 CFIDHN CCCCC[C@H](C)NC(=O)[C@]1(N)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000160179202 378754364 /nfs/dbraw/zinc/75/43/64/378754364.db2.gz VZNUYFHPEKNEIO-QDEZUTFSSA-N 0 3 296.455 2.604 20 70 CFIDHN CN(C)[C@H](CNCc1cc(F)cc(F)c1)c1ccco1 ZINC000159581566 378718917 /nfs/dbraw/zinc/71/89/17/378718917.db2.gz BOBDKNRTQOHCII-CQSZACIVSA-N 0 3 280.318 2.950 20 70 CFIDHN CC[C@H](COC)N[C@@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000159612326 378720352 /nfs/dbraw/zinc/72/03/52/378720352.db2.gz HRABSWQEOAQVOY-GXTWGEPZSA-N 0 3 299.436 2.556 20 70 CFIDHN Cc1c2ccccc2oc1[C@@H](NC(=O)[C@@H](C)N)C(C)C ZINC000159696193 378724971 /nfs/dbraw/zinc/72/49/71/378724971.db2.gz HEVHRLACGVYTRY-RISCZKNCSA-N 0 3 274.364 2.902 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000159721960 378726332 /nfs/dbraw/zinc/72/63/32/378726332.db2.gz MFVHNVDHLDAEBG-KFWWJZLASA-N 0 3 260.381 2.566 20 70 CFIDHN Cc1ccnc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000160214047 378756515 /nfs/dbraw/zinc/75/65/15/378756515.db2.gz MPAMMBBKWXKWHK-XJKSGUPXSA-N 0 3 282.391 2.717 20 70 CFIDHN CSC[C@@H](CCO)N[C@@H]1CCCOc2ccc(C)cc21 ZINC000160275851 378760455 /nfs/dbraw/zinc/76/04/55/378760455.db2.gz JDKKXKGZPVVZEI-UKRRQHHQSA-N 0 3 295.448 2.912 20 70 CFIDHN COC(=O)c1cc(CN(C)Cc2ccccc2C)c[nH]1 ZINC000160525287 378778462 /nfs/dbraw/zinc/77/84/62/378778462.db2.gz CMBQUCYJOLGYDF-UHFFFAOYSA-N 0 3 272.348 2.742 20 70 CFIDHN Cn1c(CN[C@H]2CCOC(C)(C)C2)nc2ccccc21 ZINC000160524758 378779136 /nfs/dbraw/zinc/77/91/36/378779136.db2.gz AEHLIEYHXWMMQS-LBPRGKRZSA-N 0 3 273.380 2.621 20 70 CFIDHN COc1ccc([C@H](C)CCNC(=O)[C@@H](N)C(C)(C)C)cc1 ZINC000160553368 378780891 /nfs/dbraw/zinc/78/08/91/378780891.db2.gz YUFWSBAHACCTPM-IUODEOHRSA-N 0 3 292.423 2.678 20 70 CFIDHN COc1ccc(CN(CC(OC)OC)[C@H](C)C2CC2)cc1 ZINC000160669204 378789600 /nfs/dbraw/zinc/78/96/00/378789600.db2.gz TYFMAJJJTOVDIT-CYBMUJFWSA-N 0 3 293.407 2.915 20 70 CFIDHN COc1cccc([C@H](O)CN[C@@H](C)c2ccco2)c1 ZINC000160783711 378798221 /nfs/dbraw/zinc/79/82/21/378798221.db2.gz DUZDQQYBPNTQDK-SMDDNHRTSA-N 0 3 261.321 2.672 20 70 CFIDHN CC[C@@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(F)cc1F ZINC000161201621 378829060 /nfs/dbraw/zinc/82/90/60/378829060.db2.gz NEAPDGIMRFDDCU-SMDDNHRTSA-N 0 3 282.334 2.626 20 70 CFIDHN CCCN(CCO)Cc1ccc(OC)c(OC(F)F)c1 ZINC000161216148 378830861 /nfs/dbraw/zinc/83/08/61/378830861.db2.gz LPRCYVLKXJLOFQ-UHFFFAOYSA-N 0 3 289.322 2.501 20 70 CFIDHN CC(C)NC(=O)CN[C@@H]1c2cccc(F)c2CC[C@@H]1C ZINC000160915044 378809964 /nfs/dbraw/zinc/80/99/64/378809964.db2.gz FCUCKEVGLNOIOF-ZBEGNZNMSA-N 0 3 278.371 2.563 20 70 CFIDHN C[C@H](N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000160985484 378813576 /nfs/dbraw/zinc/81/35/76/378813576.db2.gz NBARJVOQTJUJBK-BQBZGAKWSA-N 0 3 261.152 2.518 20 70 CFIDHN Cc1ccc(C(=O)CCN(C)C[C@@H]2CCC[C@@H]2O)cc1 ZINC000161030701 378815957 /nfs/dbraw/zinc/81/59/57/378815957.db2.gz CXTCKACKXZJQKI-HOTGVXAUSA-N 0 3 275.392 2.661 20 70 CFIDHN CCCC[C@H](COC)N[C@H](CCO)c1ccccc1 ZINC000161046331 378817760 /nfs/dbraw/zinc/81/77/60/378817760.db2.gz JEVNINMDNOVJNF-HZPDHXFCSA-N 0 3 265.397 2.905 20 70 CFIDHN Cc1ccc([C@@H](C)CN[C@H](C(N)=O)c2ccccc2)cc1 ZINC000161051203 378818543 /nfs/dbraw/zinc/81/85/43/378818543.db2.gz XLARHNCQQOPUAI-YOEHRIQHSA-N 0 3 282.387 2.915 20 70 CFIDHN CCN(C(=O)[C@H](C)N)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000161115228 378823129 /nfs/dbraw/zinc/82/31/29/378823129.db2.gz GNTHBRXZKWXSPI-UWVGGRQHSA-N 0 3 288.313 2.962 20 70 CFIDHN CC(C)C[C@H](N)C(=O)NC[C@@H](C)Oc1ccc(Cl)cc1 ZINC000161133119 378824287 /nfs/dbraw/zinc/82/42/87/378824287.db2.gz DGHSCGCWALJATG-RISCZKNCSA-N 0 3 298.814 2.597 20 70 CFIDHN C[C@@H](NCCCc1nnc2n1CCCCC2)c1ccco1 ZINC000161169798 378828235 /nfs/dbraw/zinc/82/82/35/378828235.db2.gz ZIFMPBDJPRIIRZ-CYBMUJFWSA-N 0 3 288.395 2.881 20 70 CFIDHN CCC[C@H](C(=O)N[C@H]1CCc2ccccc21)N(C)C ZINC000161346453 378841640 /nfs/dbraw/zinc/84/16/40/378841640.db2.gz SOAOSLCAZKTZQQ-LSDHHAIUSA-N 0 3 260.381 2.520 20 70 CFIDHN Cc1cc(C(=O)NC[C@H]2CCCN2CC(C)C)oc1C ZINC000160575709 322340028 /nfs/dbraw/zinc/34/00/28/322340028.db2.gz RIWBGCGZQFXGSM-CQSZACIVSA-N 0 3 278.396 2.747 20 70 CFIDHN CCN(Cc1ccncc1)C[C@H](O)c1ccccc1F ZINC000218153531 382789576 /nfs/dbraw/zinc/78/95/76/382789576.db2.gz XCBJZKAIOAEHDR-INIZCTEOSA-N 0 3 274.339 2.776 20 70 CFIDHN CCN(C)C(=O)CN[C@@H]1CCCc2c3ccccc3[nH]c21 ZINC000217350679 130760503 /nfs/dbraw/zinc/76/05/03/130760503.db2.gz CTEUMWFGVSAGJI-OAHLLOKOSA-N 0 3 285.391 2.613 20 70 CFIDHN CC[C@@H]1CCCC[C@H]1NC(=O)N1CCCN(CC)CC1 ZINC000159684007 394365748 /nfs/dbraw/zinc/36/57/48/394365748.db2.gz AZYBOBZZGIEEOF-HUUCEWRRSA-N 0 3 281.444 2.692 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1ccccc1 ZINC000159681419 322326224 /nfs/dbraw/zinc/32/62/24/322326224.db2.gz IXACCIANVSWZBQ-ZFWWWQNUSA-N 0 3 258.365 2.890 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)N1CCCCCC1 ZINC000159684271 322326875 /nfs/dbraw/zinc/32/68/75/322326875.db2.gz AQQZBLAUGPVVMK-GJZGRUSLSA-N 0 3 264.413 2.654 20 70 CFIDHN CC(C)N(CCc1nccs1)Cc1ccncc1 ZINC000159855139 322329200 /nfs/dbraw/zinc/32/92/00/322329200.db2.gz MMYCXJGZKWWNMQ-UHFFFAOYSA-N 0 3 261.394 2.991 20 70 CFIDHN CCCCN(C)CCNC(=O)[C@H](C)c1ccsc1 ZINC000159952434 322331026 /nfs/dbraw/zinc/33/10/26/322331026.db2.gz SWHFZJCYSXNKNR-GFCCVEGCSA-N 0 3 268.426 2.700 20 70 CFIDHN Cc1ccc([C@H](CNC(=O)NC2(C)CCC2)N(C)C)cc1 ZINC000160213223 322334762 /nfs/dbraw/zinc/33/47/62/322334762.db2.gz TYIOSIPSNUIXGI-HNNXBMFYSA-N 0 3 289.423 2.840 20 70 CFIDHN CCN(CC(=O)NCc1ccc(F)cc1)CC(C)(C)C ZINC000160238017 322335036 /nfs/dbraw/zinc/33/50/36/322335036.db2.gz RCFRBUXZXKTONT-UHFFFAOYSA-N 0 3 280.387 2.810 20 70 CFIDHN CCN1CCCC[C@@H]1C(=O)NCCCSCC(C)C ZINC000160771213 322342743 /nfs/dbraw/zinc/34/27/43/322342743.db2.gz UFXYQHOYPONWQK-CQSZACIVSA-N 0 3 286.485 2.756 20 70 CFIDHN C[C@@H](NCCCCS(C)(=O)=O)c1ccccc1Cl ZINC000161192581 322348505 /nfs/dbraw/zinc/34/85/05/322348505.db2.gz OWMSRXBRQKOUEN-LLVKDONJSA-N 0 3 289.828 2.815 20 70 CFIDHN CCCN(CCO)Cc1ccccc1OC(F)(F)F ZINC000161228302 322349477 /nfs/dbraw/zinc/34/94/77/322349477.db2.gz VAKTZWBWUDREAC-UHFFFAOYSA-N 0 3 277.286 2.790 20 70 CFIDHN CN(C)Cc1ccc(C(=O)NC[C@H]2CC=CCC2)cc1 ZINC000161307769 322349876 /nfs/dbraw/zinc/34/98/76/322349876.db2.gz NIBZOQTXBJNTFV-AWEZNQCLSA-N 0 3 272.392 2.834 20 70 CFIDHN CCCN1CCCN(C(=O)c2cc(C)c(C)s2)CC1 ZINC000160401242 519850797 /nfs/dbraw/zinc/85/07/97/519850797.db2.gz JLXQMFAGWDDRCI-UHFFFAOYSA-N 0 3 280.437 2.923 20 70 CFIDHN CCCN1CCCN(C(=O)c2ccc3c(c2)CCC3)CC1 ZINC000160387139 519851171 /nfs/dbraw/zinc/85/11/71/519851171.db2.gz YCYIJOFUPLBOFN-UHFFFAOYSA-N 0 3 286.419 2.733 20 70 CFIDHN CCOc1ccccc1[C@@H](C)N[C@@H](CCO)CSC ZINC000160366596 521573099 /nfs/dbraw/zinc/57/30/99/521573099.db2.gz FFVQXURSKBJFTF-OLZOCXBDSA-N 0 3 283.437 2.850 20 70 CFIDHN CC[C@H](C)c1cc(C(=O)NCCN2CCC[C@H](C)C2)on1 ZINC000160590824 522028173 /nfs/dbraw/zinc/02/81/73/522028173.db2.gz CFYGTEBMKWPTDA-STQMWFEESA-N 0 3 293.411 2.650 20 70 CFIDHN CCc1nc(CN2C[C@H](c3ccccc3)C(C)(C)C2)n[nH]1 ZINC000159369820 522325275 /nfs/dbraw/zinc/32/52/75/522325275.db2.gz VIUOPMIENGURBF-CQSZACIVSA-N 0 3 284.407 2.993 20 70 CFIDHN CC[C@@H](C)c1cc(C(=O)NCCN2CCC[C@H](C)C2)on1 ZINC000160590700 522419554 /nfs/dbraw/zinc/41/95/54/522419554.db2.gz CFYGTEBMKWPTDA-QWHCGFSZSA-N 0 3 293.411 2.650 20 70 CFIDHN CCc1ccc([C@H](C)NC(=O)[C@H](N)[C@H](C)CC)cc1 ZINC000217779533 524044879 /nfs/dbraw/zinc/04/48/79/524044879.db2.gz KWPXHODIJXLRND-TYNCELHUSA-N 0 3 262.397 2.800 20 70 CFIDHN C[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)CC[C@@H]1O ZINC000159425750 524992156 /nfs/dbraw/zinc/99/21/56/524992156.db2.gz KRGUFMNNFMHFHE-MFKMUULPSA-N 0 3 273.298 2.908 20 70 CFIDHN NC(=O)CC1CCN(Cc2cc3cc(F)ccc3o2)CC1 ZINC000159728231 526862173 /nfs/dbraw/zinc/86/21/73/526862173.db2.gz YBBGIXKYLRHCLW-UHFFFAOYSA-N 0 3 290.338 2.659 20 70 CFIDHN CC(C)OCCN(CCc1nccs1)C(C)C ZINC000159733071 527953785 /nfs/dbraw/zinc/95/37/85/527953785.db2.gz STALXQGOYXFHTK-UHFFFAOYSA-N 0 3 256.415 2.821 20 70 CFIDHN CCN1CCCC[C@H]1C(=O)NCCc1cc2ccccc2[nH]1 ZINC000159662125 529006603 /nfs/dbraw/zinc/00/66/03/529006603.db2.gz FTSVGOULPQHTLW-KRWDZBQOSA-N 0 3 299.418 2.701 20 70 CFIDHN CCN(C(=O)N[C@H]1CCN(CC2CC2)C1)C1CCCCC1 ZINC000160641419 348019941 /nfs/dbraw/zinc/01/99/41/348019941.db2.gz TWESKKCYLQXWFF-HNNXBMFYSA-N 0 3 293.455 2.835 20 70 CFIDHN CCC[C@@H](N)C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000159811796 188443459 /nfs/dbraw/zinc/44/34/59/188443459.db2.gz HZOMLMNITPCLER-TZMCWYRMSA-N 0 3 280.799 2.783 20 70 CFIDHN CCCn1nccc1CNCCc1ccc(F)cc1 ZINC000159956254 540665766 /nfs/dbraw/zinc/66/57/66/540665766.db2.gz UFTJSSHTAYLVRS-UHFFFAOYSA-N 0 3 261.344 2.765 20 70 CFIDHN CCCn1nccc1CNCCc1ccccc1F ZINC000159961901 540666197 /nfs/dbraw/zinc/66/61/97/540666197.db2.gz OATVEWXXKBDVQM-UHFFFAOYSA-N 0 3 261.344 2.765 20 70 CFIDHN CCCn1nccc1CN[C@@H](C)CCc1ccco1 ZINC000159985470 540666348 /nfs/dbraw/zinc/66/63/48/540666348.db2.gz OQELPGWDLDRVGF-ZDUSSCGKSA-N 0 3 261.369 2.997 20 70 CFIDHN CCCn1nccc1CNCC1(O)CCC(C)(C)CC1 ZINC000160161711 540669156 /nfs/dbraw/zinc/66/91/56/540669156.db2.gz NLKWYSRCGPMLNY-UHFFFAOYSA-N 0 3 279.428 2.714 20 70 CFIDHN CC(C)C(=O)NCCCN[C@@H]1CCc2c1cc(F)cc2F ZINC000159976537 541019538 /nfs/dbraw/zinc/01/95/38/541019538.db2.gz PAMKMRNTROHUNC-OAHLLOKOSA-N 0 3 296.361 2.704 20 70 CFIDHN COC[C@H](NCc1ccc(OC(C)C)nc1)C(C)C ZINC000160088566 378747624 /nfs/dbraw/zinc/74/76/24/378747624.db2.gz ZNSUQHGQMBYTTE-AWEZNQCLSA-N 0 3 266.385 2.629 20 70 CFIDHN Fc1cc(F)cc(CNCCCOC[C@H]2CCCO2)c1 ZINC000159643298 378721620 /nfs/dbraw/zinc/72/16/20/378721620.db2.gz CQOPSIORNICXCY-OAHLLOKOSA-N 0 3 285.334 2.640 20 70 CFIDHN CCC1(CNC(=O)N(CCN(C)C)C(C)C)CCCC1 ZINC000159675998 378724430 /nfs/dbraw/zinc/72/44/30/378724430.db2.gz DPWJNEGPYIICGM-UHFFFAOYSA-N 0 3 283.460 2.938 20 70 CFIDHN CCCCOc1ccc([C@@H](C)NCCO)cc1OC ZINC000159713293 378725905 /nfs/dbraw/zinc/72/59/05/378725905.db2.gz NHVQCXWQEYLUTE-GFCCVEGCSA-N 0 3 267.369 2.517 20 70 CFIDHN NC(=O)[C@@H](NCCC1Cc2ccccc2C1)c1ccccc1 ZINC000159734568 378727767 /nfs/dbraw/zinc/72/77/67/378727767.db2.gz XLOQIEADZFQMPW-SFHVURJKSA-N 0 3 294.398 2.608 20 70 CFIDHN CCN1CCCC[C@H]1CNC(=O)[C@@H](C)c1cccs1 ZINC000159769793 378729121 /nfs/dbraw/zinc/72/91/21/378729121.db2.gz PRMAULQQNISJRA-STQMWFEESA-N 0 3 280.437 2.842 20 70 CFIDHN CCC(=O)N1CC[C@@H](N[C@H](C)c2ccccc2C)C1 ZINC000159819989 378731701 /nfs/dbraw/zinc/73/17/01/378731701.db2.gz QWZKGNDDNZEPHV-ZIAGYGMSSA-N 0 3 260.381 2.657 20 70 CFIDHN COc1ccc(OC)c(CN[C@@H]2CCOC(C)(C)C2)c1 ZINC000160461826 378774278 /nfs/dbraw/zinc/77/42/78/378774278.db2.gz OUVAMFRIHFDCNG-CYBMUJFWSA-N 0 3 279.380 2.751 20 70 CFIDHN Cc1c(CN[C@H](C)Cc2ccccc2F)cnn1C ZINC000160755772 378797194 /nfs/dbraw/zinc/79/71/94/378797194.db2.gz ODJIXDITUNSDSV-LLVKDONJSA-N 0 3 261.344 2.588 20 70 CFIDHN COc1ccc(CN2CC[C@]3(O)CCCC[C@@H]3C2)cc1F ZINC000160792512 378799078 /nfs/dbraw/zinc/79/90/78/378799078.db2.gz LXPJNFHYPDDURP-RHSMWYFYSA-N 0 3 293.382 2.961 20 70 CFIDHN CCCN(CCO)Cc1cccc(OC)c1OC(F)F ZINC000161217664 378831211 /nfs/dbraw/zinc/83/12/11/378831211.db2.gz MNQMDRBOGHZYEE-UHFFFAOYSA-N 0 3 289.322 2.501 20 70 CFIDHN C[C@H]1C[C@H](Nc2cnccn2)CN1Cc1ccccc1 ZINC000160930574 378809502 /nfs/dbraw/zinc/80/95/02/378809502.db2.gz MSQYLGMPNVDXRE-ZFWWWQNUSA-N 0 3 268.364 2.552 20 70 CFIDHN CN(Cc1cnn(-c2ccccc2)c1)[C@@H]1CCCC[C@@H]1O ZINC000161083680 378819524 /nfs/dbraw/zinc/81/95/24/378819524.db2.gz NMOUNGNSBHNARB-SJORKVTESA-N 0 3 285.391 2.608 20 70 CFIDHN CC[C@@H](C(=O)N1CCC2(C1)CCCCC2)N(C)C ZINC000161085888 378819597 /nfs/dbraw/zinc/81/95/97/378819597.db2.gz RTBUFNJYGUUYOM-ZDUSSCGKSA-N 0 3 252.402 2.509 20 70 CFIDHN CC(C)C[C@H](N)C(=O)NC[C@H](C)Oc1ccc(Cl)cc1 ZINC000161133360 378823965 /nfs/dbraw/zinc/82/39/65/378823965.db2.gz DGHSCGCWALJATG-FZMZJTMJSA-N 0 3 298.814 2.597 20 70 CFIDHN Cc1ccc([C@@H](C)CNC(=O)[C@H](N)Cc2ccccc2)cc1 ZINC000161169364 378827827 /nfs/dbraw/zinc/82/78/27/378827827.db2.gz WGDSCPBOEDAWAX-MAUKXSAKSA-N 0 3 296.414 2.785 20 70 CFIDHN CC(=O)NC1CCC(N[C@@H](C)c2nc(C)cs2)CC1 ZINC000161415364 378844665 /nfs/dbraw/zinc/84/46/65/378844665.db2.gz QONPEMAMIBSRPY-PKSQDBQZSA-N 0 3 281.425 2.549 20 70 CFIDHN Cc1ncc([C@H](C)NC[C@H](CO)c2ccccc2)c(C)n1 ZINC000161469834 378849583 /nfs/dbraw/zinc/84/95/83/378849583.db2.gz KVGFVHFLAOLTLI-BLLLJJGKSA-N 0 3 285.391 2.520 20 70 CFIDHN CC[C@@H](C)NC(=O)CCNCc1cccc2cc[nH]c21 ZINC000218145863 382789267 /nfs/dbraw/zinc/78/92/67/382789267.db2.gz WDQCNRJOYZQOHE-GFCCVEGCSA-N 0 3 273.380 2.562 20 70 CFIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1nccs1 ZINC000160518824 394366386 /nfs/dbraw/zinc/36/63/86/394366386.db2.gz IPZYVIFFPYWYGZ-MNOVXSKESA-N 0 3 269.414 2.838 20 70 CFIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@H]1CCC[C@@H](C)C1 ZINC000160366036 394366551 /nfs/dbraw/zinc/36/65/51/394366551.db2.gz RDYRHDOSNIIEDN-ILXRZTDVSA-N 0 3 266.429 2.803 20 70 CFIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@@H]1CCC[C@@H](C)C1 ZINC000160366246 394366621 /nfs/dbraw/zinc/36/66/21/394366621.db2.gz RDYRHDOSNIIEDN-QLFBSQMISA-N 0 3 266.429 2.803 20 70 CFIDHN CCO[C@H]1C[C@H](NC(=O)[C@@H](N)CC(C)C)C12CCCCC2 ZINC000161182771 286533403 /nfs/dbraw/zinc/53/34/03/286533403.db2.gz DINMGSCHLDJQLY-KKUMJFAQSA-N 0 3 296.455 2.604 20 70 CFIDHN CS[C@@H](C)CC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C ZINC000161378323 286688683 /nfs/dbraw/zinc/68/86/83/286688683.db2.gz HLDNGRBEEZUZJQ-ZFWWWQNUSA-N 0 3 294.464 2.856 20 70 CFIDHN C([C@@H]1CCCN1c1nc(C2CC2)ns1)N1CCCCC1 ZINC000160429824 275396434 /nfs/dbraw/zinc/39/64/34/275396434.db2.gz FODQFMYNSXIKAC-ZDUSSCGKSA-N 0 3 292.452 2.870 20 70 CFIDHN C([C@H]1CCCN1c1nc(C2CC2)ns1)N1CCCCC1 ZINC000160429945 275397510 /nfs/dbraw/zinc/39/75/10/275397510.db2.gz FODQFMYNSXIKAC-CYBMUJFWSA-N 0 3 292.452 2.870 20 70 CFIDHN CO[C@@]1(C)C[C@@H](NCc2ccccc2NC(C)=O)C1(C)C ZINC000160511881 277702257 /nfs/dbraw/zinc/70/22/57/277702257.db2.gz CODOOPPEMDYLKN-WBVHZDCISA-N 0 3 290.407 2.938 20 70 CFIDHN CSC[C@@](C)(O)CNCc1ccccc1C(F)(F)F ZINC000217867403 278136582 /nfs/dbraw/zinc/13/65/82/278136582.db2.gz GIBOFKJKCZJCRQ-LBPRGKRZSA-N 0 3 293.354 2.909 20 70 CFIDHN CCC[C@H](N[C@H]1CCN(C(=O)CC)C1)c1ccccn1 ZINC000159385096 322322317 /nfs/dbraw/zinc/32/23/17/322322317.db2.gz LWUQCZVCZLYPCA-ZFWWWQNUSA-N 0 3 275.396 2.523 20 70 CFIDHN COCCCCN1CCN([C@H](C)c2cccc(F)c2)CC1 ZINC000159498477 322323541 /nfs/dbraw/zinc/32/35/41/322323541.db2.gz WBFYLOHECRJMAR-OAHLLOKOSA-N 0 3 294.414 2.931 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)NC(C1CC1)C1CC1 ZINC000159579916 322324463 /nfs/dbraw/zinc/32/44/63/322324463.db2.gz ZVRHWJGUBFAGLP-WFASDCNBSA-N 0 3 276.424 2.556 20 70 CFIDHN C[C@@H](CN1CCCCC1)NC(=O)NCC1(C2CC2)CCC1 ZINC000159612741 322325014 /nfs/dbraw/zinc/32/50/14/322325014.db2.gz DOHXWNRYGCITLC-AWEZNQCLSA-N 0 3 293.455 2.740 20 70 CFIDHN Cc1ccc(CNC(=O)CN2CC[C@@H]3CCCC[C@@H]32)cc1 ZINC000159657423 322326100 /nfs/dbraw/zinc/32/61/00/322326100.db2.gz NURCLROFXNLJSW-IRXDYDNUSA-N 0 3 286.419 2.876 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)NCc1cccs1 ZINC000159658007 322326522 /nfs/dbraw/zinc/32/65/22/322326522.db2.gz BLZOXSDDKTUGJO-JSGCOSHPSA-N 0 3 278.421 2.629 20 70 CFIDHN CCCC(=O)Nc1cccc(CN[C@H](CC)COC)c1 ZINC000159934721 322330316 /nfs/dbraw/zinc/33/03/16/322330316.db2.gz WVMDTZBYGYQSLC-CQSZACIVSA-N 0 3 278.396 2.940 20 70 CFIDHN Cc1cccc([C@H]2CCCN2CCOC[C@@H]2CCCO2)n1 ZINC000160240166 322335333 /nfs/dbraw/zinc/33/53/33/322335333.db2.gz ULPWJKREONYUKF-DOTOQJQBSA-N 0 3 290.407 2.723 20 70 CFIDHN CS[C@H](C)CC(=O)N1CCN(CCC(C)(C)C)CC1 ZINC000160718536 322341809 /nfs/dbraw/zinc/34/18/09/322341809.db2.gz XDHMKKXIZKPOFJ-CYBMUJFWSA-N 0 3 286.485 2.708 20 70 CFIDHN C[C@@H](NC[C@@H]1CCc2ccccc21)c1cnccn1 ZINC000160973047 322345409 /nfs/dbraw/zinc/34/54/09/322345409.db2.gz WGKSUKLEADHCLC-OCCSQVGLSA-N 0 3 253.349 2.857 20 70 CFIDHN CCCN(CCO)Cc1cccn1CCC(C)C ZINC000161237114 322349218 /nfs/dbraw/zinc/34/92/18/322349218.db2.gz SGSUTVXNGYRFGK-UHFFFAOYSA-N 0 3 252.402 2.739 20 70 CFIDHN CSc1cc(C(=O)N(C)CCN2CCCC2)ccc1F ZINC000161366273 322351027 /nfs/dbraw/zinc/35/10/27/322351027.db2.gz AEQFROAVATYAER-UHFFFAOYSA-N 0 3 296.411 2.715 20 70 CFIDHN CC(C)n1cc([C@H](C)NC[C@@H]2CCCC[C@@H]2O)cn1 ZINC000160621735 519979454 /nfs/dbraw/zinc/97/94/54/519979454.db2.gz WLCGBAWUJVQHCL-YDHLFZDLSA-N 0 3 265.401 2.666 20 70 CFIDHN CCN1CCCC[C@H]1CN[C@@H](C)c1cncs1 ZINC000161173697 521602752 /nfs/dbraw/zinc/60/27/52/521602752.db2.gz WGAISUPGXRXSGC-RYUDHWBXSA-N 0 3 253.415 2.668 20 70 CFIDHN CCN1CCCC[C@H]1CN[C@@H](C)c1cnn(C(C)C)c1 ZINC000161206393 521603846 /nfs/dbraw/zinc/60/38/46/521603846.db2.gz CBXYCKBNEAJNNR-HOCLYGCPSA-N 0 3 278.444 2.989 20 70 CFIDHN CC[C@@H](C)c1cc(C(=O)N[C@H](C)CN2CCCCC2)on1 ZINC000160369701 522425224 /nfs/dbraw/zinc/42/52/24/522425224.db2.gz GHLZMJUQDYYTEH-CHWSQXEVSA-N 0 3 293.411 2.792 20 70 CFIDHN CC[C@@H](NCCOCC(F)(F)F)c1c(C)nn(C)c1C ZINC000159375683 522837180 /nfs/dbraw/zinc/83/71/80/522837180.db2.gz QTTQDJQQFRSSCU-LLVKDONJSA-N 0 3 293.333 2.657 20 70 CFIDHN CC[C@@H](NCCOCCOC)c1ccc(F)cc1F ZINC000160824634 522837609 /nfs/dbraw/zinc/83/76/09/522837609.db2.gz IKDQAVMILVPJIK-CQSZACIVSA-N 0 3 273.323 2.669 20 70 CFIDHN Cc1cccc([C@H](C)NCC(=O)NC2CCCC2)c1 ZINC000160246999 524872673 /nfs/dbraw/zinc/87/26/73/524872673.db2.gz NZWAJBJYSMOLJX-ZDUSSCGKSA-N 0 3 260.381 2.704 20 70 CFIDHN COc1ccc([C@@H](C)N[C@@H](CCO)CSC)cc1F ZINC000160218505 525161432 /nfs/dbraw/zinc/16/14/32/525161432.db2.gz LWYJXAHKJKWYOI-PWSUYJOCSA-N 0 3 287.400 2.599 20 70 CFIDHN CSC[C@H](CCO)N[C@@H](C)c1ccc(C)cc1 ZINC000160396850 525698562 /nfs/dbraw/zinc/69/85/62/525698562.db2.gz AEIQYPQWJWNMJX-JSGCOSHPSA-N 0 3 253.411 2.760 20 70 CFIDHN Cc1ccc(C(=O)CCN(C)[C@H](CO)C(C)(C)C)cc1 ZINC000160904353 526042647 /nfs/dbraw/zinc/04/26/47/526042647.db2.gz YKQWATKEVNRXSP-MRXNPFEDSA-N 0 3 277.408 2.907 20 70 CFIDHN CCN1CCCN(C(=O)NCC2(CC(C)C)CC2)CC1 ZINC000159970769 529022509 /nfs/dbraw/zinc/02/25/09/529022509.db2.gz GMISMCDWPBKEIS-UHFFFAOYSA-N 0 3 281.444 2.550 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H]1CCCc3sccc31)CC2 ZINC000160493083 282126577 /nfs/dbraw/zinc/12/65/77/282126577.db2.gz PUEWRNHZNFWYFO-DGCLKSJQSA-N 0 3 288.420 2.630 20 70 CFIDHN CCOCCCN1CCC(NC(=O)C2CCCCC2)CC1 ZINC000159745855 348014275 /nfs/dbraw/zinc/01/42/75/348014275.db2.gz PXTWWGRJOWMEDD-UHFFFAOYSA-N 0 3 296.455 2.574 20 70 CFIDHN CCOC(CCNCc1ccc(OC)cc1OC)OCC ZINC000159547065 188431200 /nfs/dbraw/zinc/43/12/00/188431200.db2.gz UHNHIEVSZDVVQW-UHFFFAOYSA-N 0 3 297.395 2.583 20 70 CFIDHN CC(C)NC(=O)CN[C@H]1c2cccc(F)c2CC[C@@H]1C ZINC000160914880 188498040 /nfs/dbraw/zinc/49/80/40/188498040.db2.gz FCUCKEVGLNOIOF-MEDUHNTESA-N 0 3 278.371 2.563 20 70 CFIDHN Cc1ccc([C@H](C)CNC(=O)[C@H](N)CC(C)C)cc1 ZINC000159655440 540661136 /nfs/dbraw/zinc/66/11/36/540661136.db2.gz RYIRGXQOUSHHCB-UKRRQHHQSA-N 0 3 262.397 2.588 20 70 CFIDHN C[C@@H](N)C(=O)N[C@@H](CC1CCCCC1)C(C)(C)C ZINC000160073491 296014917 /nfs/dbraw/zinc/01/49/17/296014917.db2.gz BFMGYLUCCGFUCA-YPMHNXCESA-N 0 3 254.418 2.835 20 70 CFIDHN CCC1(CNC(=O)N[C@@H]2CCN(CC3CC3)C2)CCCC1 ZINC000161105934 541540372 /nfs/dbraw/zinc/54/03/72/541540372.db2.gz JXDGGSDWRQTXGO-OAHLLOKOSA-N 0 3 293.455 2.740 20 70 CFIDHN CCN(CC)Cc1cccc(NC(=O)c2cc(C)ncn2)c1 ZINC000161502714 541663131 /nfs/dbraw/zinc/66/31/31/541663131.db2.gz UPBWPINERSHQKB-UHFFFAOYSA-N 0 3 298.390 2.879 20 70 CFIDHN CC[C@@H](C(=O)N[C@@H]1CCSc2c(F)cccc21)N(C)C ZINC000160097328 378748333 /nfs/dbraw/zinc/74/83/33/378748333.db2.gz ABBFACKOQWJTPW-OLZOCXBDSA-N 0 3 296.411 2.819 20 70 CFIDHN Cc1cncc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000160233523 378757914 /nfs/dbraw/zinc/75/79/14/378757914.db2.gz DETSYUYOSOHCQJ-XJKSGUPXSA-N 0 3 282.391 2.717 20 70 CFIDHN CN(Cc1ccc(F)c(F)c1)C[C@@H]1CCC[C@@H]1O ZINC000159539239 378715757 /nfs/dbraw/zinc/71/57/57/378715757.db2.gz YSBVRDIJWNOGIF-FZMZJTMJSA-N 0 3 255.308 2.558 20 70 CFIDHN Cc1cccc2c(CCNC(=O)C3(N)CCCCC3)c[nH]c21 ZINC000159560693 378716602 /nfs/dbraw/zinc/71/66/02/378716602.db2.gz GGLNQANSNUSBHO-UHFFFAOYSA-N 0 3 299.418 2.797 20 70 CFIDHN C[C@@H](NC(=O)[C@H]1CCCCN1)c1ccc(F)cc1Cl ZINC000159625255 378721734 /nfs/dbraw/zinc/72/17/34/378721734.db2.gz NMPKIBMDSWIUBV-NOZJJQNGSA-N 0 3 284.762 2.798 20 70 CFIDHN Clc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)cn1 ZINC000159649268 378722989 /nfs/dbraw/zinc/72/29/89/378722989.db2.gz XNIGWSPBNSIARK-UBHSHLNASA-N 0 3 278.783 2.782 20 70 CFIDHN CC(C)[C@H](N)C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000159812973 378731452 /nfs/dbraw/zinc/73/14/52/378731452.db2.gz NOQQKEZABVNVPM-OCCSQVGLSA-N 0 3 280.799 2.639 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(Cl)s1)CC2 ZINC000160370373 378767214 /nfs/dbraw/zinc/76/72/14/378767214.db2.gz OVDMBGOAHFAPIK-WPRPVWTQSA-N 0 3 296.827 2.967 20 70 CFIDHN C[C@H]1CN(C)CC[C@@H]1N(C)c1nc2cc(F)ccc2o1 ZINC000160426295 378772641 /nfs/dbraw/zinc/77/26/41/378772641.db2.gz HUGDUHCZGZGNIQ-GWCFXTLKSA-N 0 3 277.343 2.743 20 70 CFIDHN O[C@H]1CCCC[C@@H]1NCc1ccc(Cl)cc1F ZINC000160810702 378800204 /nfs/dbraw/zinc/80/02/04/378800204.db2.gz YVQQHUIMEHJUEK-STQMWFEESA-N 0 3 257.736 2.872 20 70 CFIDHN Cn1c(CN[C@@H]2CCOC(C)(C)C2)nc2ccccc21 ZINC000160524665 378779309 /nfs/dbraw/zinc/77/93/09/378779309.db2.gz AEHLIEYHXWMMQS-GFCCVEGCSA-N 0 3 273.380 2.621 20 70 CFIDHN CCc1nnc(CN[C@H](C)[C@@H](C)c2ccccc2)[nH]1 ZINC000160563424 378782887 /nfs/dbraw/zinc/78/28/87/378782887.db2.gz BICDJGAHAHBNRZ-VXGBXAGGSA-N 0 3 258.369 2.649 20 70 CFIDHN CCc1nnc(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)[n-]1 ZINC000160563424 378782894 /nfs/dbraw/zinc/78/28/94/378782894.db2.gz BICDJGAHAHBNRZ-VXGBXAGGSA-N 0 3 258.369 2.649 20 70 CFIDHN COc1cc(CNC(C)(C)[C@@H](C)O)c(SC)cc1OC ZINC000161117190 378823170 /nfs/dbraw/zinc/82/31/70/378823170.db2.gz BTXTUHSKXILNCN-SNVBAGLBSA-N 0 3 299.436 2.675 20 70 CFIDHN CC[C@H](C)[C@@H](N)C(=O)NC[C@@H](C)Oc1ccc(Cl)cc1 ZINC000161138010 378824115 /nfs/dbraw/zinc/82/41/15/378824115.db2.gz HQFOUCDKZNGQQU-MISXGVKJSA-N 0 3 298.814 2.597 20 70 CFIDHN CCN(C[C@@H](O)c1cc2ccccc2o1)C[C@@H]1CCCO1 ZINC000216953295 382785227 /nfs/dbraw/zinc/78/52/27/382785227.db2.gz DKUBMMHXKILCOP-LSDHHAIUSA-N 0 3 289.375 2.967 20 70 CFIDHN CC[C@H](C)NC(=O)CCNCc1cccc2cc[nH]c21 ZINC000218145944 382789384 /nfs/dbraw/zinc/78/93/84/382789384.db2.gz WDQCNRJOYZQOHE-LBPRGKRZSA-N 0 3 273.380 2.562 20 70 CFIDHN CCC[N@H+](CC)CCNC(=O)c1cc([O-])ccc1Cl ZINC000218475398 382790337 /nfs/dbraw/zinc/79/03/37/382790337.db2.gz IVJKICVQYZQNCY-UHFFFAOYSA-N 0 3 284.787 2.507 20 70 CFIDHN CCC[N@@H+](CC)CCNC(=O)c1cc([O-])ccc1Cl ZINC000218475398 382790338 /nfs/dbraw/zinc/79/03/38/382790338.db2.gz IVJKICVQYZQNCY-UHFFFAOYSA-N 0 3 284.787 2.507 20 70 CFIDHN COCC[C@](C)(O)CN[C@H](C)c1ccc(Cl)c(F)c1 ZINC000218252364 397620642 /nfs/dbraw/zinc/62/06/42/397620642.db2.gz ZQWBLVGOUVVODU-YGRLFVJLSA-N 0 3 289.778 2.917 20 70 CFIDHN CCO[C@@H]1C[C@H](NC(=O)[C@@H](N)CC(C)C)C12CCCCC2 ZINC000161182643 286371404 /nfs/dbraw/zinc/37/14/04/286371404.db2.gz DINMGSCHLDJQLY-SOUVJXGZSA-N 0 3 296.455 2.604 20 70 CFIDHN Cc1cc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)c(C)s1 ZINC000160332850 280651871 /nfs/dbraw/zinc/65/18/71/280651871.db2.gz FVRANQVEUGJKTC-GXFFZTMASA-N 0 3 290.436 2.930 20 70 CFIDHN Cc1ccc([C@H](C)N[C@H](C)C(=O)N2CCCC2)c(C)c1 ZINC000159729127 280980493 /nfs/dbraw/zinc/98/04/93/280980493.db2.gz GREHKWPMUCTKOT-LSDHHAIUSA-N 0 3 274.408 2.965 20 70 CFIDHN CCc1ccc([C@@H](CNC(=O)C2(C)CC2)N(C)C)cc1 ZINC000159652146 322325651 /nfs/dbraw/zinc/32/56/51/322325651.db2.gz ZUBLWMWIXPDIOU-OAHLLOKOSA-N 0 3 274.408 2.768 20 70 CFIDHN Cc1cccc([C@@H]2CCCN2CCOCC2CC2)n1 ZINC000160241002 322335142 /nfs/dbraw/zinc/33/51/42/322335142.db2.gz OODFEBGCQCCXIL-INIZCTEOSA-N 0 3 260.381 2.954 20 70 CFIDHN C[C@@H]1C[C@@H](NC(=O)C2CCC(C)(C)CC2)CN1C1CC1 ZINC000161105649 322347435 /nfs/dbraw/zinc/34/74/35/322347435.db2.gz QTGLZDHKLQFNKF-TZMCWYRMSA-N 0 3 278.440 2.944 20 70 CFIDHN Cc1ncc([C@@H](C)NCCc2ccc3c(c2)OCO3)c(C)n1 ZINC000161124121 322347509 /nfs/dbraw/zinc/34/75/09/322347509.db2.gz RBPMUWCHBJBLBR-LLVKDONJSA-N 0 3 299.374 2.715 20 70 CFIDHN CCCN(CC1CCCCCC1)[C@H]1CCS(=O)(=O)C1 ZINC000161112337 322347548 /nfs/dbraw/zinc/34/75/48/322347548.db2.gz JZQMSZHNTYAJTN-HNNXBMFYSA-N 0 3 287.469 2.856 20 70 CFIDHN C[C@H](NCCc1ccc2c(c1)OCO2)c1ccco1 ZINC000161144942 322348302 /nfs/dbraw/zinc/34/83/02/322348302.db2.gz JSKCJOVJVOOLFO-NSHDSACASA-N 0 3 259.305 2.902 20 70 CFIDHN CCN(CC)c1ncc(CNCC2(CO)CCCC2)s1 ZINC000160082502 520933326 /nfs/dbraw/zinc/93/33/26/520933326.db2.gz UVRNPUYVMKSMMS-UHFFFAOYSA-N 0 3 297.468 2.632 20 70 CFIDHN CCOCCN(CC)Cc1c(C)nc2ccccn21 ZINC000160240910 519909444 /nfs/dbraw/zinc/90/94/44/519909444.db2.gz OZFFTGFVGMZGEC-UHFFFAOYSA-N 0 3 261.369 2.501 20 70 CFIDHN CC[C@@H](C)N(C)CCNC(=O)Nc1cccc(C(C)=O)c1 ZINC000217401471 522057921 /nfs/dbraw/zinc/05/79/21/522057921.db2.gz YXEATTWGVWMXNQ-GFCCVEGCSA-N 0 3 291.395 2.741 20 70 CFIDHN CN(C[C@@H]1CCCN(C)C1)c1nc(C(C)(C)C)ns1 ZINC000159508373 523044069 /nfs/dbraw/zinc/04/40/69/523044069.db2.gz NAEJDMPQUQRPLH-LLVKDONJSA-N 0 3 282.457 2.614 20 70 CFIDHN Cc1ccc(C(=O)CCN2C[C@H](C)N(C)[C@@H](C)C2)cc1 ZINC000160216685 526043946 /nfs/dbraw/zinc/04/39/46/526043946.db2.gz JFWKVZKUPNJWLK-GJZGRUSLSA-N 0 3 274.408 2.592 20 70 CFIDHN O=C(/C=C/c1c(Cl)cccc1Cl)N1CCCNCC1 ZINC000160845858 527600262 /nfs/dbraw/zinc/60/02/62/527600262.db2.gz IDRSCOIJAOITLZ-AATRIKPKSA-N 0 3 299.201 2.829 20 70 CFIDHN OC[C@H]1CCCCN1CCc1ccccc1Cl ZINC000159992479 527614693 /nfs/dbraw/zinc/61/46/93/527614693.db2.gz WPBIPYCIFNZBAW-CYBMUJFWSA-N 0 3 253.773 2.729 20 70 CFIDHN CCCC1(CNC(=O)N(CCN(C)C)C(C)C)CCC1 ZINC000159626013 528046596 /nfs/dbraw/zinc/04/65/96/528046596.db2.gz YUWUZMGAZOAFIZ-UHFFFAOYSA-N 0 3 283.460 2.938 20 70 CFIDHN CCC[C@@H](C(=O)N[C@H]1CCc2ccccc21)N(C)C ZINC000161346316 528847633 /nfs/dbraw/zinc/84/76/33/528847633.db2.gz SOAOSLCAZKTZQQ-GJZGRUSLSA-N 0 3 260.381 2.520 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(C)cc1)CC2 ZINC000160548171 282118774 /nfs/dbraw/zinc/11/87/74/282118774.db2.gz WIWBNOMEQAFQGQ-DOMZBBRYSA-N 0 3 270.380 2.561 20 70 CFIDHN CC[C@@H](C)[C@H](N)C(=O)N1CCC[C@H](CC(C)C)C1 ZINC000161475085 529417269 /nfs/dbraw/zinc/41/72/69/529417269.db2.gz MTDGSVGVFGHMTQ-MCIONIFRSA-N 0 3 254.418 2.645 20 70 CFIDHN c1ccc(N[C@H]2CCN(CCOCC3CC3)C2)cc1 ZINC000160277810 232247588 /nfs/dbraw/zinc/24/75/88/232247588.db2.gz RGAWVLYJKBGUBQ-INIZCTEOSA-N 0 3 260.381 2.599 20 70 CFIDHN CC(C)[C@H]1CCCCN1C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000160625537 348019101 /nfs/dbraw/zinc/01/91/01/348019101.db2.gz WQARAVSITYZTDG-JKSUJKDBSA-N 0 3 293.455 2.691 20 70 CFIDHN C[C@H]1CN(C(=O)N[C@@H]2CCN(CC3CC3)C2)c2ccccc21 ZINC000160760100 348020799 /nfs/dbraw/zinc/02/07/99/348020799.db2.gz CFKWJASMCWHDKU-DZGCQCFKSA-N 0 3 299.418 2.804 20 70 CFIDHN CCO[C@H]1C[C@@H](NCc2nn(C)c3ccccc23)C1(C)C ZINC000217879760 348165807 /nfs/dbraw/zinc/16/58/07/348165807.db2.gz CKQVJJGGWWUJBC-CVEARBPZSA-N 0 3 287.407 2.867 20 70 CFIDHN C[C@@H](NCC1C2CC3CC(C2)CC1C3)c1nncn1C ZINC000216824629 539623818 /nfs/dbraw/zinc/62/38/18/539623818.db2.gz ZMSJQRNMZDZVHZ-IBEXFIOLSA-N 0 3 274.412 2.538 20 70 CFIDHN Cc1ccc([C@@H](C)CNC(=O)[C@H](N)CC(C)C)cc1 ZINC000159655295 540660503 /nfs/dbraw/zinc/66/05/03/540660503.db2.gz RYIRGXQOUSHHCB-DZGCQCFKSA-N 0 3 262.397 2.588 20 70 CFIDHN CCCn1nccc1CNC[C@H](c1ccccc1)N(C)C ZINC000159972953 540666289 /nfs/dbraw/zinc/66/62/89/540666289.db2.gz ZGJGHFNJLYWCGI-QGZVFWFLSA-N 0 3 286.423 2.686 20 70 CFIDHN CCn1cc([C@@H](C)NC[C@](C)(O)c2ccsc2)cn1 ZINC000160024675 378744104 /nfs/dbraw/zinc/74/41/04/378744104.db2.gz ZYDONWLHXUXNNI-RISCZKNCSA-N 0 3 279.409 2.523 20 70 CFIDHN CCn1cc([C@H](C)NC[C@](C)(O)c2ccsc2)cn1 ZINC000160024780 378744134 /nfs/dbraw/zinc/74/41/34/378744134.db2.gz ZYDONWLHXUXNNI-FZMZJTMJSA-N 0 3 279.409 2.523 20 70 CFIDHN C[C@]1(NCc2cc(Cl)c3c(c2)OCCCO3)CCOC1 ZINC000160181845 378754515 /nfs/dbraw/zinc/75/45/15/378754515.db2.gz KCBYTBVQUNEKDC-HNNXBMFYSA-N 0 3 297.782 2.770 20 70 CFIDHN Cc1ncc([C@H](C)N[C@@H]2CCCSC2)c(C)n1 ZINC000159562445 378716855 /nfs/dbraw/zinc/71/68/55/378716855.db2.gz RCDLUEWKRDQYKV-CMPLNLGQSA-N 0 3 251.399 2.640 20 70 CFIDHN CCc1ccc(CNC(=O)N2CCCN(CC)CC2)s1 ZINC000159662850 378723403 /nfs/dbraw/zinc/72/34/03/378723403.db2.gz NXGNXKBGMCKWCM-UHFFFAOYSA-N 0 3 295.452 2.548 20 70 CFIDHN C[C@@H](CNC(=O)N1CCC2(CCC2)C1)N1CCC[C@H](C)C1 ZINC000160269075 378761216 /nfs/dbraw/zinc/76/12/16/378761216.db2.gz XDAJIIAQWNZBCC-GJZGRUSLSA-N 0 3 293.455 2.692 20 70 CFIDHN Cc1cc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)c(C)s1 ZINC000160333085 378763566 /nfs/dbraw/zinc/76/35/66/378763566.db2.gz FVRANQVEUGJKTC-GWCFXTLKSA-N 0 3 290.436 2.930 20 70 CFIDHN C[C@@H](O)C(C)(C)NCc1csc(Br)c1 ZINC000160620539 378785843 /nfs/dbraw/zinc/78/58/43/378785843.db2.gz TYKUKHVIIPDCDP-SSDOTTSWSA-N 0 3 278.215 2.760 20 70 CFIDHN CC[C@@H](NC(=O)[C@@H](N)C(C)C)c1ccc(F)cc1F ZINC000161210203 378831598 /nfs/dbraw/zinc/83/15/98/378831598.db2.gz BGFKKJSQVLRMIO-OLZOCXBDSA-N 0 3 270.323 2.515 20 70 CFIDHN CCCN(CCO)Cc1ccc(CSC(F)F)o1 ZINC000161227423 378832254 /nfs/dbraw/zinc/83/22/54/378832254.db2.gz WUNQFVXDULNVAD-UHFFFAOYSA-N 0 3 279.352 2.940 20 70 CFIDHN Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)[C@H](C)N)cc1 ZINC000161234193 378833105 /nfs/dbraw/zinc/83/31/05/378833105.db2.gz AURGJYPCEQUJAM-KCQAQPDRSA-N 0 3 260.381 2.642 20 70 CFIDHN CCC[C@]1(C)CCCN(C(=O)[C@@H](N)Cc2ccccc2)C1 ZINC000160932294 378810124 /nfs/dbraw/zinc/81/01/24/378810124.db2.gz KJINLIFFTIIGIT-FUHWJXTLSA-N 0 3 288.435 2.985 20 70 CFIDHN CCC(CC)c1cc(CNC(=O)[C@@H](N)CC(C)C)on1 ZINC000161108592 378821208 /nfs/dbraw/zinc/82/12/08/378821208.db2.gz KUTZSASVAVLJAN-ZDUSSCGKSA-N 0 3 281.400 2.568 20 70 CFIDHN COC(CN(C)[C@H](c1ccccc1)C(C)C)OC ZINC000161087603 378821864 /nfs/dbraw/zinc/82/18/64/378821864.db2.gz QUOKIJQJXMLNEE-HNNXBMFYSA-N 0 3 251.370 2.934 20 70 CFIDHN CC[C@@H](C)[C@H](N)C(=O)NC[C@@H](C)Sc1ccccc1 ZINC000161119619 378822660 /nfs/dbraw/zinc/82/26/60/378822660.db2.gz ANVNWRITSIYBPL-BZPMIXESSA-N 0 3 280.437 2.657 20 70 CFIDHN COc1ccc(CNC(C)(C)[C@@H](C)O)cc1OC(F)F ZINC000161124071 378822889 /nfs/dbraw/zinc/82/28/89/378822889.db2.gz LZXJCHUIUBYMFG-SECBINFHSA-N 0 3 289.322 2.546 20 70 CFIDHN C[C@H](O)C(C)(C)NCc1cccc2c1OC(C)(C)C2 ZINC000161122963 378822932 /nfs/dbraw/zinc/82/29/32/378822932.db2.gz SPJPOLHQKQJAMP-NSHDSACASA-N 0 3 263.381 2.649 20 70 CFIDHN CS[C@@H](C)CC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000161500962 378850818 /nfs/dbraw/zinc/85/08/18/378850818.db2.gz DAOWLBOTXGCKCV-ZDUSSCGKSA-N 0 3 298.452 2.620 20 70 CFIDHN C[C@@H]1CCC[C@H](C(=O)NC2CCN(C3CC3)CC2)C1 ZINC000159370341 322321777 /nfs/dbraw/zinc/32/17/77/322321777.db2.gz YJQQMHMAVRSMOJ-OLZOCXBDSA-N 0 3 264.413 2.556 20 70 CFIDHN CSC[C@@](C)(O)CNCc1ccccc1OC(C)C ZINC000217847291 382788009 /nfs/dbraw/zinc/78/80/09/382788009.db2.gz HSIZSDCIUOROHI-HNNXBMFYSA-N 0 3 283.437 2.677 20 70 CFIDHN CCN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@@H]1c1sccc1C ZINC000159907813 285259186 /nfs/dbraw/zinc/25/91/86/285259186.db2.gz IULSHZLAZQHTBV-HZSPNIEDSA-N 0 3 292.448 2.761 20 70 CFIDHN CC[C@H](C(=O)N[C@@H]1CCSc2c(F)cccc21)N(C)C ZINC000160097443 394366091 /nfs/dbraw/zinc/36/60/91/394366091.db2.gz ABBFACKOQWJTPW-CHWSQXEVSA-N 0 3 296.411 2.819 20 70 CFIDHN CCO[C@H]1C[C@H](NC(=O)[C@@H](N)C(C)(C)C)C12CCCCC2 ZINC000161179247 286533560 /nfs/dbraw/zinc/53/35/60/286533560.db2.gz YXSFAJOTXUTJJU-MELADBBJSA-N 0 3 296.455 2.604 20 70 CFIDHN CN1CCC[C@@H](CNC(=O)N2CCC3(CCCC3)CC2)C1 ZINC000159457577 322323190 /nfs/dbraw/zinc/32/31/90/322323190.db2.gz SNFBKQLMSCBNPL-HNNXBMFYSA-N 0 3 293.455 2.694 20 70 CFIDHN COCCCCN1CCN([C@@H](C)c2cccc(F)c2)CC1 ZINC000159498341 322323353 /nfs/dbraw/zinc/32/33/53/322323353.db2.gz WBFYLOHECRJMAR-HNNXBMFYSA-N 0 3 294.414 2.931 20 70 CFIDHN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1cc2cc(F)ccc2o1 ZINC000159521317 322324210 /nfs/dbraw/zinc/32/42/10/322324210.db2.gz YZCCIGWRBKYGJT-MNOVXSKESA-N 0 3 290.338 2.658 20 70 CFIDHN CC[C@@H](OC1CCCCC1)C(=O)NC1CCN(CC)CC1 ZINC000159588799 322324515 /nfs/dbraw/zinc/32/45/15/322324515.db2.gz LQHVCUHYRQFBOX-MRXNPFEDSA-N 0 3 296.455 2.715 20 70 CFIDHN COc1ccccc1NC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159672127 322326161 /nfs/dbraw/zinc/32/61/61/322326161.db2.gz YOBALRHJWJIHTN-ZFWWWQNUSA-N 0 3 288.391 2.898 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)NCc1ccccc1 ZINC000159681657 322326502 /nfs/dbraw/zinc/32/65/02/322326502.db2.gz SIIASHMNTZUTGG-HOTGVXAUSA-N 0 3 272.392 2.567 20 70 CFIDHN Cc1cc(C)c(C(=O)N[C@@H](CN(C)C)c2ccccc2)[nH]1 ZINC000159844295 322329245 /nfs/dbraw/zinc/32/92/45/322329245.db2.gz AXHTXJBSHSGPKN-HNNXBMFYSA-N 0 3 285.391 2.664 20 70 CFIDHN CCn1c(CNCC2(CO)CCCC2)nc2ccccc21 ZINC000160065860 322332484 /nfs/dbraw/zinc/33/24/84/322332484.db2.gz REHADNMFXNNBSP-UHFFFAOYSA-N 0 3 287.407 2.699 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C1CC1)C1CCCC1 ZINC000160780135 322342861 /nfs/dbraw/zinc/34/28/61/322342861.db2.gz WDHOHLPAEXBMDL-UHFFFAOYSA-N 0 3 273.442 2.607 20 70 CFIDHN CCCN(CC1CCCCCC1)[C@@H]1CCS(=O)(=O)C1 ZINC000161112209 322347502 /nfs/dbraw/zinc/34/75/02/322347502.db2.gz JZQMSZHNTYAJTN-OAHLLOKOSA-N 0 3 287.469 2.856 20 70 CFIDHN CS[C@H](C)CC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000161434230 322351703 /nfs/dbraw/zinc/35/17/03/322351703.db2.gz NRCZCZNINQRESO-CQSZACIVSA-N 0 3 298.496 2.853 20 70 CFIDHN CCCN1CCCN(C(=O)c2cc(F)ccc2C)CC1 ZINC000160356084 519850840 /nfs/dbraw/zinc/85/08/40/519850840.db2.gz DHHQDZHTMJCVLY-UHFFFAOYSA-N 0 3 278.371 2.692 20 70 CFIDHN CC1(C)C[C@H](NCC[S@](=O)c2ccccc2)C(C)(C)O1 ZINC000160787912 520553338 /nfs/dbraw/zinc/55/33/38/520553338.db2.gz JALFFFIYLOPXHO-VBKZILBWSA-N 0 3 295.448 2.730 20 70 CFIDHN CCO[C@H]1C[C@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160569921 520567062 /nfs/dbraw/zinc/56/70/62/520567062.db2.gz AGFVRXUSVUMGFY-GJZGRUSLSA-N 0 3 287.407 2.970 20 70 CFIDHN CCC[C@@H](C)CC(=O)N1CCCN(CCC)CC1 ZINC000160370582 520621067 /nfs/dbraw/zinc/62/10/67/520621067.db2.gz LKWVBPMUKIEZEJ-CQSZACIVSA-N 0 3 254.418 2.757 20 70 CFIDHN CCCCSCCC(=O)NCCN1CCCCC1 ZINC000159890226 520950847 /nfs/dbraw/zinc/95/08/47/520950847.db2.gz SATZDUYQDVIIOD-UHFFFAOYSA-N 0 3 272.458 2.512 20 70 CFIDHN CCc1nc(CN[C@@H](c2ccccc2)C2CC2)n[nH]1 ZINC000160541183 522350125 /nfs/dbraw/zinc/35/01/25/522350125.db2.gz KJRUCSTVQQYGBP-HNNXBMFYSA-N 0 3 256.353 2.608 20 70 CFIDHN CC[C@@H](C)c1cc(C(=O)NCCN2CCCC[C@@H]2C)on1 ZINC000160581732 522419519 /nfs/dbraw/zinc/41/95/19/522419519.db2.gz OYRLICWMAUMBPR-OLZOCXBDSA-N 0 3 293.411 2.792 20 70 CFIDHN COC[C@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161149674 522628214 /nfs/dbraw/zinc/62/82/14/522628214.db2.gz GIHYPISAXFJKKU-ZBEGNZNMSA-N 0 3 277.364 2.533 20 70 CFIDHN CCc1ccc(CC(=O)NC2CCN(C3CC3)CC2)cc1 ZINC000159366325 523907232 /nfs/dbraw/zinc/90/72/32/523907232.db2.gz WMMPWMIFSSHADB-UHFFFAOYSA-N 0 3 286.419 2.535 20 70 CFIDHN C[C@H](NCc1cccc2cc[nH]c21)C(=O)N1CCCCC1 ZINC000218126230 525460425 /nfs/dbraw/zinc/46/04/25/525460425.db2.gz WEPINXUKEJCBQI-ZDUSSCGKSA-N 0 3 285.391 2.659 20 70 CFIDHN CSCC[C@@H](C)N(C)Cc1cnc2ccccn12 ZINC000160508211 525526783 /nfs/dbraw/zinc/52/67/83/525526783.db2.gz HDMPGXQJDMWHLS-GFCCVEGCSA-N 0 3 263.410 2.908 20 70 CFIDHN Cc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)s1 ZINC000160302985 525744630 /nfs/dbraw/zinc/74/46/30/525744630.db2.gz TWNOGJYLIZFOQH-ZYHUDNBSSA-N 0 3 276.409 2.622 20 70 CFIDHN COc1cccc(CCCN2CCOCC2(C)C)c1 ZINC000159519595 525886214 /nfs/dbraw/zinc/88/62/14/525886214.db2.gz XEKVXTRVEPDKPR-UHFFFAOYSA-N 0 3 263.381 2.739 20 70 CFIDHN CCCC1(CNC(=O)N2CCCN(CC)CC2)CCC1 ZINC000159980633 528045979 /nfs/dbraw/zinc/04/59/79/528045979.db2.gz WUVGJCKRXQMIEX-UHFFFAOYSA-N 0 3 281.444 2.694 20 70 CFIDHN CCCCc1ccc([C@@H](C)N[C@@H](C)CC(N)=O)cc1 ZINC000161359151 529028399 /nfs/dbraw/zinc/02/83/99/529028399.db2.gz JRHKFPYIDJDOMM-QWHCGFSZSA-N 0 3 262.397 2.944 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(C)cc1)CC2 ZINC000160548303 282117545 /nfs/dbraw/zinc/11/75/45/282117545.db2.gz WIWBNOMEQAFQGQ-WFASDCNBSA-N 0 3 270.380 2.561 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccccc1C)CC2 ZINC000159597219 282117600 /nfs/dbraw/zinc/11/76/00/282117600.db2.gz HZTHAJRQXJHSNO-JSGCOSHPSA-N 0 3 270.380 2.561 20 70 CFIDHN c1c(CNC2Cc3ccccc3C2)nc2ccccn12 ZINC000159426975 232244769 /nfs/dbraw/zinc/24/47/69/232244769.db2.gz MGIZGNPCKIWPFK-UHFFFAOYSA-N 0 3 263.344 2.591 20 70 CFIDHN CCN1CCCC[C@@H]1CNC(=O)[C@@H](C)c1ccsc1 ZINC000159770222 348013950 /nfs/dbraw/zinc/01/39/50/348013950.db2.gz SJWLVQRQELUKBZ-GXTWGEPZSA-N 0 3 280.437 2.842 20 70 CFIDHN FC(F)(F)c1nnc(N[C@@H]2CCN3CCCC[C@@H]23)s1 ZINC000160327050 348016776 /nfs/dbraw/zinc/01/67/76/348016776.db2.gz WDKZMHPDOKXGJP-SFYZADRCSA-N 0 3 292.330 2.596 20 70 CFIDHN CC[C@H]1CCCN(C(=O)N[C@@H]2CCN(CC3CC3)C2)CC1 ZINC000160700531 348019683 /nfs/dbraw/zinc/01/96/83/348019683.db2.gz FYCDSGMEWXESFY-GOEBONIOSA-N 0 3 293.455 2.692 20 70 CFIDHN Cc1ccc2c(c1)N(C(=O)N[C@@H]1CCN(CC3CC3)C1)CC2 ZINC000160652246 348019855 /nfs/dbraw/zinc/01/98/55/348019855.db2.gz KBAKYBAQYYUAGO-MRXNPFEDSA-N 0 3 299.418 2.551 20 70 CFIDHN C[C@@H]1CCCC[C@H]1N(C)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160714038 348020569 /nfs/dbraw/zinc/02/05/69/348020569.db2.gz RXQVGWAXSVCNHZ-FVQBIDKESA-N 0 3 293.455 2.691 20 70 CFIDHN Cc1ccc2cc(C(=O)N3CCC[C@H](N(C)C)C3)ccc2n1 ZINC000161480803 188530073 /nfs/dbraw/zinc/53/00/73/188530073.db2.gz ICLUPDHMLXUCIT-INIZCTEOSA-N 0 3 297.402 2.709 20 70 CFIDHN CCCn1nccc1CNC[C@H](c1cccs1)N(C)C ZINC000159987289 540666775 /nfs/dbraw/zinc/66/67/75/540666775.db2.gz KICGSUQXGOEJSE-CQSZACIVSA-N 0 3 292.452 2.747 20 70 CFIDHN CCn1nccc1CN[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000159976936 541019517 /nfs/dbraw/zinc/01/95/17/541019517.db2.gz NDFJZSILXOHXQW-QGZVFWFLSA-N 0 3 298.434 2.657 20 70 CFIDHN CCn1nccc1CNC1CCN(c2ccccc2)CC1 ZINC000160110541 541021623 /nfs/dbraw/zinc/02/16/23/541021623.db2.gz BPGTZDLWFUDTEP-UHFFFAOYSA-N 0 3 284.407 2.662 20 70 CFIDHN CS(=O)(=O)CCCCN1CCC[C@@H]1C1CCCCC1 ZINC000161500601 541656790 /nfs/dbraw/zinc/65/67/90/541656790.db2.gz LNWCFLVEODSKMN-OAHLLOKOSA-N 0 3 287.469 2.856 20 70 CFIDHN Cc1cc(Cl)ccc1C(=O)N(C)[C@@H]1CCCN(C)C1 ZINC000159908601 378737403 /nfs/dbraw/zinc/73/74/03/378737403.db2.gz SRSXZNCRILLGQH-CYBMUJFWSA-N 0 3 280.799 2.815 20 70 CFIDHN Cc1cc(Cl)ccc1C(=O)N(C)[C@H]1CCCN(C)C1 ZINC000159908736 378737810 /nfs/dbraw/zinc/73/78/10/378737810.db2.gz SRSXZNCRILLGQH-ZDUSSCGKSA-N 0 3 280.799 2.815 20 70 CFIDHN C/C(=C\c1ccccc1Cl)C(=O)NC1CCN(C)CC1 ZINC000160243466 378757490 /nfs/dbraw/zinc/75/74/90/378757490.db2.gz MYHLKDMXOPFFIF-VAWYXSNFSA-N 0 3 292.810 2.954 20 70 CFIDHN O=C1C[C@H]2CC[C@@H](C1)N2Cc1cccc2cccnc21 ZINC000159568583 378716826 /nfs/dbraw/zinc/71/68/26/378716826.db2.gz MIYAKNANXANNBS-GASCZTMLSA-N 0 3 266.344 2.931 20 70 CFIDHN CCSCCN1CCc2ccc(OC)cc2C1 ZINC000159622588 378721827 /nfs/dbraw/zinc/72/18/27/378721827.db2.gz BCQOLLWGGKJTHD-UHFFFAOYSA-N 0 3 251.395 2.806 20 70 CFIDHN CCCN1CCN(Cc2c[nH]nc2-c2ccccc2)CC1 ZINC000159667315 378722598 /nfs/dbraw/zinc/72/25/98/378722598.db2.gz BHRIBSYIFOVNHK-UHFFFAOYSA-N 0 3 284.407 2.604 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000159716973 378725988 /nfs/dbraw/zinc/72/59/88/378725988.db2.gz LDNIMBRCQPPYDU-KKUMJFAQSA-N 0 3 292.448 2.519 20 70 CFIDHN CC[C@@H](NC(=O)[C@H]1CCCCN1)c1ccc(F)cc1F ZINC000159725917 378727711 /nfs/dbraw/zinc/72/77/11/378727711.db2.gz MLORBGCQOHISPZ-ZIAGYGMSSA-N 0 3 282.334 2.674 20 70 CFIDHN C[C@H](N[C@H](CC(N)=O)C1CCCCC1)c1ccccn1 ZINC000159751901 378728867 /nfs/dbraw/zinc/72/88/67/378728867.db2.gz KZDKMIQYLKWEBO-SWLSCSKDSA-N 0 3 275.396 2.557 20 70 CFIDHN O=C([C@H]1CCCCN1)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000159806071 378731685 /nfs/dbraw/zinc/73/16/85/378731685.db2.gz JCUCUVITYKVDOO-DZGCQCFKSA-N 0 3 292.810 2.798 20 70 CFIDHN CCc1nc(C)c([C@@H](C)N(C)CCn2ccnc2)s1 ZINC000159848707 378733459 /nfs/dbraw/zinc/73/34/59/378733459.db2.gz UNQRAAKSMLUGFD-GFCCVEGCSA-N 0 3 278.425 2.903 20 70 CFIDHN CC[C@@H](C(=O)NCc1ccccc1OCC(C)C)N(C)C ZINC000160295162 378762228 /nfs/dbraw/zinc/76/22/28/378762228.db2.gz UMVFNIZDIQIHPR-HNNXBMFYSA-N 0 3 292.423 2.678 20 70 CFIDHN CC(C)N(C)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160380285 378766720 /nfs/dbraw/zinc/76/67/20/378766720.db2.gz XCBZKZPTLOSQNC-HOCLYGCPSA-N 0 3 289.423 2.699 20 70 CFIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@@H]1CCC[C@H](C)C1 ZINC000160366376 378767306 /nfs/dbraw/zinc/76/73/06/378767306.db2.gz RDYRHDOSNIIEDN-SOUVJXGZSA-N 0 3 266.429 2.803 20 70 CFIDHN CC1(C)C[C@@H](NCc2cccnc2Cl)CCO1 ZINC000160440287 378772543 /nfs/dbraw/zinc/77/25/43/378772543.db2.gz YSKVRXXAUZJNNK-NSHDSACASA-N 0 3 254.761 2.782 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1cc3ccccc3o1)CC2 ZINC000160551295 378780422 /nfs/dbraw/zinc/78/04/22/378780422.db2.gz RCLIFPCFYGOKSR-BXUZGUMPSA-N 0 3 296.374 2.998 20 70 CFIDHN O=C(N1CC[C@H](N2CCCCC2)C1)N1CCCCCC1 ZINC000160557993 378781036 /nfs/dbraw/zinc/78/10/36/378781036.db2.gz FSVWCAJXPIKIMK-HNNXBMFYSA-N 0 3 279.428 2.543 20 70 CFIDHN Cc1cc(C)c2c(c1)[C@@H](NCC(C)(C)O)CCCO2 ZINC000160640782 378788583 /nfs/dbraw/zinc/78/85/83/378788583.db2.gz UFLYKAYNPWMMTR-AWEZNQCLSA-N 0 3 263.381 2.878 20 70 CFIDHN CCCOc1cc(CN(CCC)CCO)ccc1OC ZINC000161222993 378831588 /nfs/dbraw/zinc/83/15/88/378831588.db2.gz LSBAQEGIKXWAHE-UHFFFAOYSA-N 0 3 281.396 2.688 20 70 CFIDHN NC1(C(=O)N[C@H](Cc2ccccc2)C2CC2)CCCCC1 ZINC000161260347 378834763 /nfs/dbraw/zinc/83/47/63/378834763.db2.gz DRTICUFCOFZUCA-MRXNPFEDSA-N 0 3 286.419 2.786 20 70 CFIDHN CCC[C@@H](N)C(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000161163286 378826921 /nfs/dbraw/zinc/82/69/21/378826921.db2.gz FDWXRNFVLSCNQL-GFCCVEGCSA-N 0 3 268.788 2.819 20 70 CFIDHN CCC[C@@H](C(=O)N[C@@H]1CCc2ccccc21)N(C)C ZINC000161346068 378840512 /nfs/dbraw/zinc/84/05/12/378840512.db2.gz SOAOSLCAZKTZQQ-CABCVRRESA-N 0 3 260.381 2.520 20 70 CFIDHN C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)[C@@H](N)C(C)(C)C ZINC000161421123 378846152 /nfs/dbraw/zinc/84/61/52/378846152.db2.gz POXOXIYPCFAEPZ-BPLDGKMQSA-N 0 3 274.408 2.764 20 70 CFIDHN CS[C@@H](C)CC(=O)N(CCN(C)C)Cc1ccccc1 ZINC000161496687 378851297 /nfs/dbraw/zinc/85/12/97/378851297.db2.gz UNJSTOILVHSYGF-AWEZNQCLSA-N 0 3 294.464 2.718 20 70 CFIDHN COc1cc(CN(C)CCn2ccnc2)ccc1SC ZINC000161508152 378853355 /nfs/dbraw/zinc/85/33/55/378853355.db2.gz CYCRLKZMELPUOH-UHFFFAOYSA-N 0 3 291.420 2.746 20 70 CFIDHN CC(C)N(CCc1nccs1)Cc1cccnc1 ZINC000159803181 322328466 /nfs/dbraw/zinc/32/84/66/322328466.db2.gz VWHPYANDQFJGTE-UHFFFAOYSA-N 0 3 261.394 2.991 20 70 CFIDHN COc1c(C)cnc(CN2CCCSCC2)c1C ZINC000161485613 394367233 /nfs/dbraw/zinc/36/72/33/394367233.db2.gz XLGLUIRWJDDEDB-UHFFFAOYSA-N 0 3 266.410 2.646 20 70 CFIDHN COC(CN1C[C@@H](C)C[C@@H]1c1cccc(F)c1)OC ZINC000161271274 292079619 /nfs/dbraw/zinc/07/96/19/292079619.db2.gz LRHPOJPLFVQBHN-SMDDNHRTSA-N 0 3 267.344 2.828 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@H]1CC(C)(C)Oc2ccccc21 ZINC000161396461 276024233 /nfs/dbraw/zinc/02/42/33/276024233.db2.gz AJZYBTMNDDODME-OLZOCXBDSA-N 0 3 276.380 2.532 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000161396187 276024330 /nfs/dbraw/zinc/02/43/30/276024330.db2.gz AJZYBTMNDDODME-CHWSQXEVSA-N 0 3 276.380 2.532 20 70 CFIDHN CC1CCN(CCNC(=O)[C@H]2CCC[C@H](C)C2)CC1 ZINC000160552825 276197997 /nfs/dbraw/zinc/19/79/97/276197997.db2.gz ODIYJYDJYYXVGV-GJZGRUSLSA-N 0 3 266.429 2.661 20 70 CFIDHN CC(C)C[C@H](N)C(=O)N1CCSC2(CCCCC2)C1 ZINC000161449000 279176182 /nfs/dbraw/zinc/17/61/82/279176182.db2.gz OFONGDOUVRTORY-ZDUSSCGKSA-N 0 3 284.469 2.638 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H]2CCC[C@H](C3CC3)C2)CC1 ZINC000159909422 279286309 /nfs/dbraw/zinc/28/63/09/279286309.db2.gz ZAASPGWDDKMANF-JKSUJKDBSA-N 0 3 293.455 2.692 20 70 CFIDHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CCCCC1(C)C ZINC000159606036 279430363 /nfs/dbraw/zinc/43/03/63/279430363.db2.gz GBFNVCNWBMUFLV-CQSZACIVSA-N 0 3 283.460 2.937 20 70 CFIDHN C[C@@H](CNC(=O)NCC1(C2CC2)CC1)N1CCC(C)CC1 ZINC000159785472 322327928 /nfs/dbraw/zinc/32/79/28/322327928.db2.gz DQYRZUJWSABOQY-AWEZNQCLSA-N 0 3 293.455 2.596 20 70 CFIDHN CN(C)[C@@H]1CCCN(C(=O)C2CCC(C)(C)CC2)C1 ZINC000159877755 322329309 /nfs/dbraw/zinc/32/93/09/322329309.db2.gz QKKSUQQKGLEPFC-CQSZACIVSA-N 0 3 266.429 2.755 20 70 CFIDHN CC(C)CCCNC(=O)c1ccc(CN(C)C)cc1 ZINC000159897701 322329794 /nfs/dbraw/zinc/32/97/94/322329794.db2.gz NKNCWBNYDOLHSW-UHFFFAOYSA-N 0 3 262.397 2.914 20 70 CFIDHN CC[C@H](CNC(=O)[C@@H](C(C)C)N(C)C)c1ccccc1 ZINC000159984845 322331492 /nfs/dbraw/zinc/33/14/92/322331492.db2.gz OWWCZJHOFWVHRV-GDBMZVCRSA-N 0 3 276.424 2.883 20 70 CFIDHN CCSCC[C@@H](C)NC(=O)[C@@H]1CNCc2ccccc21 ZINC000160208564 322334704 /nfs/dbraw/zinc/33/47/04/322334704.db2.gz WDXYFKKIUWLOSN-IUODEOHRSA-N 0 3 292.448 2.521 20 70 CFIDHN COC[C@H](NCC(C)(C)O)c1cccc(C(F)(F)F)c1 ZINC000160628121 322340624 /nfs/dbraw/zinc/34/06/24/322340624.db2.gz NKCFYZZTKQRJRR-LBPRGKRZSA-N 0 3 291.313 2.753 20 70 CFIDHN C[C@H](NC[C@H]1CCc2ccccc21)c1cnccn1 ZINC000160973165 322345382 /nfs/dbraw/zinc/34/53/82/322345382.db2.gz WGKSUKLEADHCLC-GXTWGEPZSA-N 0 3 253.349 2.857 20 70 CFIDHN C(CN1CCN(CC2CCCCC2)CC1)OCC1CC1 ZINC000159701149 518388674 /nfs/dbraw/zinc/38/86/74/518388674.db2.gz GNBYCBIYTWIMPE-UHFFFAOYSA-N 0 3 280.456 2.611 20 70 CFIDHN CCCCSCCC(=O)NCCN1CCC(C)CC1 ZINC000159876644 520950317 /nfs/dbraw/zinc/95/03/17/520950317.db2.gz ACBZPXSALSHERS-UHFFFAOYSA-N 0 3 286.485 2.758 20 70 CFIDHN CC(C)C(=O)N[C@H]1CCCN(CCC2CCCC2)C1 ZINC000160126859 519514854 /nfs/dbraw/zinc/51/48/54/519514854.db2.gz AMRRWVZKOQHBEH-HNNXBMFYSA-N 0 3 266.429 2.803 20 70 CFIDHN CCCN1CCCN(C(=O)[C@@H](C)c2cccs2)CC1 ZINC000159930168 519850396 /nfs/dbraw/zinc/85/03/96/519850396.db2.gz OZNZFQVCWYJSGS-ZDUSSCGKSA-N 0 3 280.437 2.796 20 70 CFIDHN CCN1CCCC[C@@H]1CN[C@@H](C)c1cnn(C(C)C)c1 ZINC000161206224 521597455 /nfs/dbraw/zinc/59/74/55/521597455.db2.gz CBXYCKBNEAJNNR-GOEBONIOSA-N 0 3 278.444 2.989 20 70 CFIDHN CCN1CC[C@H]2CC[C@@H](C1)N2c1nc(C(C)(C)C)ns1 ZINC000159883805 521722740 /nfs/dbraw/zinc/72/27/40/521722740.db2.gz GPICYCUGNNRCJM-NEPJUHHUSA-N 0 3 294.468 2.899 20 70 CFIDHN Cc1ccc(CNc2cccc(OCCN(C)C)c2)cn1 ZINC000159566474 524619175 /nfs/dbraw/zinc/61/91/75/524619175.db2.gz LYAVYCUESGMVCU-UHFFFAOYSA-N 0 3 285.391 2.943 20 70 CFIDHN C[C@H]1CN(Cc2ccc(OC(F)(F)F)cc2)CC[C@@H]1O ZINC000159438572 524619863 /nfs/dbraw/zinc/61/98/63/524619863.db2.gz GQQWCNQBVWKMLG-GWCFXTLKSA-N 0 3 289.297 2.788 20 70 CFIDHN Cc1cccc([C@H](C)NC[C@H](O)COCC(C)C)c1 ZINC000160251513 524875686 /nfs/dbraw/zinc/87/56/86/524875686.db2.gz RCSTXPNXPMEGDC-HOCLYGCPSA-N 0 3 265.397 2.679 20 70 CFIDHN Cc1cc(Cl)ccc1C(=O)N1CC[C@H](N2CCCC2)C1 ZINC000161332917 524880660 /nfs/dbraw/zinc/88/06/60/524880660.db2.gz MDKXYMDIGQEYPV-AWEZNQCLSA-N 0 3 292.810 2.959 20 70 CFIDHN CSCCCCC(=O)NCCN1CCCC[C@H]1C ZINC000159898118 525402005 /nfs/dbraw/zinc/40/20/05/525402005.db2.gz YXMGIMPNTJCHCT-CYBMUJFWSA-N 0 3 272.458 2.510 20 70 CFIDHN Cc1nc(CN2CCN(CCC3CCCC3)CC2)oc1C ZINC000160490316 526863868 /nfs/dbraw/zinc/86/38/68/526863868.db2.gz DSHNEWFFBJXHQX-UHFFFAOYSA-N 0 3 291.439 2.989 20 70 CFIDHN N[C@H](CC(=O)N[C@@H]1C[C@@H]1c1ccccc1)c1ccccc1 ZINC000217771689 527384175 /nfs/dbraw/zinc/38/41/75/527384175.db2.gz LTWCAHXTYCCMJK-BRWVUGGUSA-N 0 3 280.371 2.749 20 70 CFIDHN CCCC1(CNC(=O)N(CCN(C)C)C(C)C)CC1 ZINC000159656832 528046524 /nfs/dbraw/zinc/04/65/24/528046524.db2.gz OOMXTILOPJLRML-UHFFFAOYSA-N 0 3 269.433 2.548 20 70 CFIDHN CC(C)N(CCc1nccs1)C[C@@H]1CCCCO1 ZINC000159787644 528917025 /nfs/dbraw/zinc/91/70/25/528917025.db2.gz SBULKHSFMJGETL-ZDUSSCGKSA-N 0 3 268.426 2.965 20 70 CFIDHN c1csc([C@@H]2CCCN(CCOCC3CC3)C2)n1 ZINC000160000924 232246535 /nfs/dbraw/zinc/24/65/35/232246535.db2.gz KQHSDJPAFFFBSD-CYBMUJFWSA-N 0 3 266.410 2.749 20 70 CFIDHN C[C@@H](O)C(C)(C)NCc1cccc2c1OC(C)(C)C2 ZINC000161123069 188509713 /nfs/dbraw/zinc/50/97/13/188509713.db2.gz SPJPOLHQKQJAMP-LLVKDONJSA-N 0 3 263.381 2.649 20 70 CFIDHN CCCC[C@@H](NC1CC=CC1)C(=O)Nc1cc(C)on1 ZINC000160893556 541491977 /nfs/dbraw/zinc/49/19/77/541491977.db2.gz YZPZQUCNXQIDOW-CYBMUJFWSA-N 0 3 277.368 2.789 20 70 CFIDHN CS(=O)(=O)CCCCN1CCC[C@H]1C1CCCCC1 ZINC000161500746 541657180 /nfs/dbraw/zinc/65/71/80/541657180.db2.gz LNWCFLVEODSKMN-HNNXBMFYSA-N 0 3 287.469 2.856 20 70 CFIDHN CCCN(C)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000159904175 378736679 /nfs/dbraw/zinc/73/66/79/378736679.db2.gz CHERWLBMVPFNNH-ZBFHGGJFSA-N 0 3 289.423 2.701 20 70 CFIDHN CC[C@H](N)C(=O)N1CCCC[C@H]1c1ccc(C)cc1 ZINC000159913190 378736730 /nfs/dbraw/zinc/73/67/30/378736730.db2.gz HEQHISUMHPVZHC-GJZGRUSLSA-N 0 3 260.381 2.786 20 70 CFIDHN CN(CCc1cccc(OC(F)(F)F)c1)[C@H]1CCOC1 ZINC000160068321 378747336 /nfs/dbraw/zinc/74/73/36/378747336.db2.gz OFMFOKIBAWQRQS-LBPRGKRZSA-N 0 3 289.297 2.848 20 70 CFIDHN CCN(C)CCNC(=O)CC/C=C/c1ccccc1 ZINC000160144951 378752060 /nfs/dbraw/zinc/75/20/60/378752060.db2.gz AWALHLBUUDHYIS-YRNVUSSQSA-N 0 3 260.381 2.548 20 70 CFIDHN COc1cccc(CCCN2CCN(CC3CC3)CC2)c1 ZINC000159404658 378706838 /nfs/dbraw/zinc/70/68/38/378706838.db2.gz SMUINXDPZKDKNP-UHFFFAOYSA-N 0 3 288.435 2.655 20 70 CFIDHN C[C@H](NC(=O)[C@H]1CCCCN1)c1ccc(F)cc1Cl ZINC000159625132 378721599 /nfs/dbraw/zinc/72/15/99/378721599.db2.gz NMPKIBMDSWIUBV-TVQRCGJNSA-N 0 3 284.762 2.798 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000159721537 378726051 /nfs/dbraw/zinc/72/60/51/378726051.db2.gz MFVHNVDHLDAEBG-QLFBSQMISA-N 0 3 260.381 2.566 20 70 CFIDHN CC[C@@H](NC(=O)[C@@H](N)CC(C)C)c1ccc(F)cc1F ZINC000159725642 378727815 /nfs/dbraw/zinc/72/78/15/378727815.db2.gz MHNYCZODKZJVOI-UONOGXRCSA-N 0 3 284.350 2.906 20 70 CFIDHN CNCC(=O)N1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 ZINC000159780535 378730351 /nfs/dbraw/zinc/73/03/51/378730351.db2.gz HSQZOOOXOMQNBE-CJNGLKHVSA-N 0 3 260.381 2.514 20 70 CFIDHN C[C@H](CNc1nnc(C(F)(F)F)s1)CN1CCCC1 ZINC000160332018 378763934 /nfs/dbraw/zinc/76/39/34/378763934.db2.gz SORFAZIEQAHALE-MRVPVSSYSA-N 0 3 294.346 2.701 20 70 CFIDHN CCc1nnc(C[NH2+][C@@H](Cc2ccc(F)cc2)C(C)C)[n-]1 ZINC000160636611 378787464 /nfs/dbraw/zinc/78/74/64/378787464.db2.gz WBSMBLMPEKDVBH-AWEZNQCLSA-N 0 3 290.386 2.863 20 70 CFIDHN CCc1nnc(CN[C@@H](Cc2ccc(F)cc2)C(C)C)[nH]1 ZINC000160636611 378787469 /nfs/dbraw/zinc/78/74/69/378787469.db2.gz WBSMBLMPEKDVBH-AWEZNQCLSA-N 0 3 290.386 2.863 20 70 CFIDHN Cc1cncc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000160233671 378758433 /nfs/dbraw/zinc/75/84/33/378758433.db2.gz DETSYUYOSOHCQJ-BBRMVZONSA-N 0 3 282.391 2.717 20 70 CFIDHN CC1(O)CCN(CCC(=O)Nc2cccc(Cl)c2)CC1 ZINC000161190936 378829292 /nfs/dbraw/zinc/82/92/92/378829292.db2.gz VKUPRVLXLAKQBY-UHFFFAOYSA-N 0 3 296.798 2.515 20 70 CFIDHN CCCN(CCO)Cc1cc(OC)c(OC)cc1SC ZINC000161197084 378829747 /nfs/dbraw/zinc/82/97/47/378829747.db2.gz VWFJWKIYHRORPC-UHFFFAOYSA-N 0 3 299.436 2.630 20 70 CFIDHN Cc1ccc(C(=O)CCN(C)CCCn2ccnc2)cc1 ZINC000161209159 378830967 /nfs/dbraw/zinc/83/09/67/378830967.db2.gz CMDKCNCLFKUOJP-UHFFFAOYSA-N 0 3 285.391 2.786 20 70 CFIDHN CCCN(CCO)Cc1c[nH]nc1-c1cccc(Cl)c1 ZINC000161220289 378831497 /nfs/dbraw/zinc/83/14/97/378831497.db2.gz AOPUNDDEZIILHG-UHFFFAOYSA-N 0 3 293.798 2.934 20 70 CFIDHN CC1(O)CCN(CCC(=O)Nc2ccccc2Cl)CC1 ZINC000161227433 378832668 /nfs/dbraw/zinc/83/26/68/378832668.db2.gz XROXYEUOWIAPSV-UHFFFAOYSA-N 0 3 296.798 2.515 20 70 CFIDHN COC(C)(C)C[C@@H](C)NC(=O)[C@@H](C)[C@H](N)c1ccccc1 ZINC000160966447 378811426 /nfs/dbraw/zinc/81/14/26/378811426.db2.gz KPFSLHDREJERLQ-IPYPFGDCSA-N 0 3 292.423 2.642 20 70 CFIDHN COC(CN(C)[C@@H](c1ccccc1)C(C)C)OC ZINC000161087706 378821048 /nfs/dbraw/zinc/82/10/48/378821048.db2.gz QUOKIJQJXMLNEE-OAHLLOKOSA-N 0 3 251.370 2.934 20 70 CFIDHN CC[C@@H](C)NC(=O)c1cccc(CN[C@@H](CC)COC)c1 ZINC000161135814 378824193 /nfs/dbraw/zinc/82/41/93/378824193.db2.gz LIDAHZLXTGUPEB-CJNGLKHVSA-N 0 3 292.423 2.730 20 70 CFIDHN CC[C@H](N)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000161135507 378824685 /nfs/dbraw/zinc/82/46/85/378824685.db2.gz CWVUZDNRHIYOTM-HNNXBMFYSA-N 0 3 276.380 2.822 20 70 CFIDHN COC(CN1CC[C@@H](C)C[C@H]1c1ccc(C)o1)OC ZINC000161337599 378841606 /nfs/dbraw/zinc/84/16/06/378841606.db2.gz GXQZQALMUJUHOS-YPMHNXCESA-N 0 3 267.369 2.980 20 70 CFIDHN CC[C@H](NCCOCCO)c1cccc(Cl)c1F ZINC000161507613 378852338 /nfs/dbraw/zinc/85/23/38/378852338.db2.gz HHGJSCUGIPNISF-LBPRGKRZSA-N 0 3 275.751 2.529 20 70 CFIDHN Cc1ccc(-n2nc(C(C)C)cc2NC(=O)[C@@H](C)N)cc1 ZINC000161295988 378838064 /nfs/dbraw/zinc/83/80/64/378838064.db2.gz BKFFHUDBNRXFRM-GFCCVEGCSA-N 0 3 286.379 2.590 20 70 CFIDHN C[C@@H](CNC(=O)C1CCC(C)(C)CC1)N(C)C1CC1 ZINC000159917142 322330657 /nfs/dbraw/zinc/33/06/57/322330657.db2.gz CLTDTLDHRIJGAU-LBPRGKRZSA-N 0 3 266.429 2.802 20 70 CFIDHN CC(C)(C)OC(=O)NCCNCc1cc(F)cc(F)c1 ZINC000218088627 382788822 /nfs/dbraw/zinc/78/88/22/382788822.db2.gz WUQJFOMPPJGATQ-UHFFFAOYSA-N 0 3 286.322 2.579 20 70 CFIDHN CC(C)[C@H](CNCc1nccn1C)c1ccccc1 ZINC000218233785 382789921 /nfs/dbraw/zinc/78/99/21/382789921.db2.gz HFDNWKKCJACPKT-HNNXBMFYSA-N 0 3 257.381 2.950 20 70 CFIDHN C[C@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccccc1 ZINC000218461193 382790350 /nfs/dbraw/zinc/79/03/50/382790350.db2.gz HKPUMDHSXFAMIP-DZGCQCFKSA-N 0 3 281.421 2.629 20 70 CFIDHN CC(C)S(=O)(=O)CCCN1CCC[C@H]1C1CCCC1 ZINC000160968266 394366847 /nfs/dbraw/zinc/36/68/47/394366847.db2.gz IIZULWJSHRIUFP-HNNXBMFYSA-N 0 3 287.469 2.854 20 70 CFIDHN COCC[C@@](C)(O)CN[C@@H](C)c1ccc(Cl)c(F)c1 ZINC000218252129 397621015 /nfs/dbraw/zinc/62/10/15/397621015.db2.gz ZQWBLVGOUVVODU-IINYFYTJSA-N 0 3 289.778 2.917 20 70 CFIDHN c1cn(C2CCN(c3ccnc4ccccc43)CC2)nn1 ZINC000160201113 275072410 /nfs/dbraw/zinc/07/24/10/275072410.db2.gz BOZZJOPLJOBIBS-UHFFFAOYSA-N 0 3 279.347 2.668 20 70 CFIDHN CC(C)(C)OC(=O)NCCN[C@@H]1CCc2c1cccc2F ZINC000218156996 275522025 /nfs/dbraw/zinc/52/20/25/275522025.db2.gz QABXYZDJULYICW-CQSZACIVSA-N 0 3 294.370 2.927 20 70 CFIDHN CC(C)n1ccnc1CN1CCN(C2CCCC2)CC1 ZINC000160760329 275787366 /nfs/dbraw/zinc/78/73/66/275787366.db2.gz VEUBZWDKFFZBAJ-UHFFFAOYSA-N 0 3 276.428 2.524 20 70 CFIDHN CCOC(=O)[C@@H]1CC[C@@H](NCc2ccco2)C[C@@H]1C ZINC000161481155 276287787 /nfs/dbraw/zinc/28/77/87/276287787.db2.gz SOFMJNFLZMULJW-OUCADQQQSA-N 0 3 265.353 2.737 20 70 CFIDHN Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)[C@H](C)N)cc1 ZINC000161233960 278862529 /nfs/dbraw/zinc/86/25/29/278862529.db2.gz AURGJYPCEQUJAM-VNHYZAJKSA-N 0 3 260.381 2.642 20 70 CFIDHN C[C@H]1CC[C@H](C(N)=O)CN1Cc1cc2cc(F)ccc2o1 ZINC000159521452 322324029 /nfs/dbraw/zinc/32/40/29/322324029.db2.gz YZCCIGWRBKYGJT-QWRGUYRKSA-N 0 3 290.338 2.658 20 70 CFIDHN C[C@H](CNC(=O)NCC1(C2CC2)CC1)N1CCC(C)CC1 ZINC000159785587 322328235 /nfs/dbraw/zinc/32/82/35/322328235.db2.gz DQYRZUJWSABOQY-CQSZACIVSA-N 0 3 293.455 2.596 20 70 CFIDHN CCC[C@@H](N)C(=O)NC1(c2ccc(Cl)cc2)CC1 ZINC000159802233 322328593 /nfs/dbraw/zinc/32/85/93/322328593.db2.gz WIMMXEFVHFIKIJ-GFCCVEGCSA-N 0 3 266.772 2.573 20 70 CFIDHN CN(C)[C@H]1CCCN(C(=O)C2CCC(C)(C)CC2)C1 ZINC000159877636 322329429 /nfs/dbraw/zinc/32/94/29/322329429.db2.gz QKKSUQQKGLEPFC-AWEZNQCLSA-N 0 3 266.429 2.755 20 70 CFIDHN CC(C)C(=O)NCCCN[C@@H](C)c1cc(F)ccc1F ZINC000159999509 322331417 /nfs/dbraw/zinc/33/14/17/322331417.db2.gz TWEGJKWCEZIMMF-NSHDSACASA-N 0 3 284.350 2.778 20 70 CFIDHN COCCOCCNC/C(C)=C/c1ccc(Cl)cc1 ZINC000160138581 322333424 /nfs/dbraw/zinc/33/34/24/322333424.db2.gz DFQPPKFQYADMAN-ACCUITESSA-N 0 3 283.799 2.996 20 70 CFIDHN CCCCNC(=O)CCN1CCC[C@@H]1c1cccc(C)n1 ZINC000160393360 322337540 /nfs/dbraw/zinc/33/75/40/322337540.db2.gz IDMWQAUJDUIPIY-MRXNPFEDSA-N 0 3 289.423 2.833 20 70 CFIDHN C[C@@H](CNC(=O)NC1(C)CCC1)N(C)Cc1ccccc1 ZINC000161118747 322347581 /nfs/dbraw/zinc/34/75/81/322347581.db2.gz ZYNIUCWSKTUYCD-AWEZNQCLSA-N 0 3 289.423 2.749 20 70 CFIDHN COc1ccc([C@@H](C)N[C@@H]2CCC(=O)N(C)C2)cc1Cl ZINC000161204031 322348676 /nfs/dbraw/zinc/34/86/76/322348676.db2.gz MQXWJWHRDCRHHY-ZYHUDNBSSA-N 0 3 296.798 2.620 20 70 CFIDHN CCOC[C@@H]1CCCN(Cc2c(C)nc3ccccn32)C1 ZINC000160411266 520116826 /nfs/dbraw/zinc/11/68/26/520116826.db2.gz PTBDYJRBNISSFR-OAHLLOKOSA-N 0 3 287.407 2.891 20 70 CFIDHN c1ccc(N2CCCN(CCOCC3CC3)CC2)cc1 ZINC000159457805 534495277 /nfs/dbraw/zinc/49/52/77/534495277.db2.gz BOMVYJNNGIPUTH-UHFFFAOYSA-N 0 3 274.408 2.625 20 70 CFIDHN CCc1nnc(C[NH2+][C@H]2C[C@@H](C)CC[C@@H]2C(C)C)[n-]1 ZINC000160545698 522357778 /nfs/dbraw/zinc/35/77/78/522357778.db2.gz MSMQTEBSCDJIQB-XQQFMLRXSA-N 0 3 264.417 2.918 20 70 CFIDHN COC(CN1CCC(Oc2ccc(C)c(C)c2)CC1)OC ZINC000160606814 522530446 /nfs/dbraw/zinc/53/04/46/522530446.db2.gz PUEGOBDBKRSGKB-UHFFFAOYSA-N 0 3 293.407 2.766 20 70 CFIDHN CC[C@H](NCCOCCOC)c1ccc(F)cc1F ZINC000160824529 522597271 /nfs/dbraw/zinc/59/72/71/522597271.db2.gz IKDQAVMILVPJIK-AWEZNQCLSA-N 0 3 273.323 2.669 20 70 CFIDHN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1cnc(C(C)(C)C)s1 ZINC000159645913 524568913 /nfs/dbraw/zinc/56/89/13/524568913.db2.gz ILNOCXCICGYIEH-GHMZBOCLSA-N 0 3 295.452 2.526 20 70 CFIDHN Cc1cccc([C@@H](C)NC[C@@H](O)COCC(C)C)c1 ZINC000160225996 524829916 /nfs/dbraw/zinc/82/99/16/524829916.db2.gz RCSTXPNXPMEGDC-GDBMZVCRSA-N 0 3 265.397 2.679 20 70 CFIDHN CSCC[C@@H](N)C(=O)N[C@@H](C)CCC1CCCCC1 ZINC000160916015 525545771 /nfs/dbraw/zinc/54/57/71/525545771.db2.gz IMIZHPGMFKFWRM-GXTWGEPZSA-N 0 3 286.485 2.932 20 70 CFIDHN CC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(C)cc1 ZINC000159921189 529167713 /nfs/dbraw/zinc/16/77/13/529167713.db2.gz UHCQJQMBGZFFQX-BFHYXJOUSA-N 0 3 262.397 2.949 20 70 CFIDHN CCSCCN(C)Cc1cccc(N(C)C)c1 ZINC000159853180 529178651 /nfs/dbraw/zinc/17/86/51/529178651.db2.gz MGNDBCYWTRLUIQ-UHFFFAOYSA-N 0 3 252.427 2.938 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1cc(F)cc(F)c1)CC2 ZINC000160456619 282127062 /nfs/dbraw/zinc/12/70/62/282127062.db2.gz CIIWJYHUSVXHPK-YMTOWFKASA-N 0 3 292.333 2.530 20 70 CFIDHN COc1cccc(NC(=O)CN2CC[C@@H]3CCCC[C@@H]32)c1 ZINC000159685141 348014089 /nfs/dbraw/zinc/01/40/89/348014089.db2.gz JYKFEBFHBNJVMD-BBRMVZONSA-N 0 3 288.391 2.898 20 70 CFIDHN CC(C)CN(C(=O)CN1CC[C@@H]2CCCC[C@@H]21)C1CC1 ZINC000159727452 348014443 /nfs/dbraw/zinc/01/44/43/348014443.db2.gz ICBAKCWADUZXBR-HOCLYGCPSA-N 0 3 278.440 2.898 20 70 CFIDHN C[C@@H]1Cc2ccccc2N1C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160664852 348019805 /nfs/dbraw/zinc/01/98/05/348019805.db2.gz GFEJOBGQNPVTCM-CZUORRHYSA-N 0 3 299.418 2.632 20 70 CFIDHN C[C@@H]1CCCC[C@@H]1N(C)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160713773 348020758 /nfs/dbraw/zinc/02/07/58/348020758.db2.gz RXQVGWAXSVCNHZ-BMFZPTHFSA-N 0 3 293.455 2.691 20 70 CFIDHN C[C@@H]1CN(C(=O)N[C@@H]2CCN(CC3CC3)C2)c2ccccc21 ZINC000160759968 348020812 /nfs/dbraw/zinc/02/08/12/348020812.db2.gz CFKWJASMCWHDKU-UKRRQHHQSA-N 0 3 299.418 2.804 20 70 CFIDHN Fc1cc(Cl)cc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)c1 ZINC000160965259 539730574 /nfs/dbraw/zinc/73/05/74/539730574.db2.gz UZDHSVPTINQJGR-UPJWGTAASA-N 0 3 255.720 2.889 20 70 CFIDHN C[C@H](CC(=O)N(C)[C@H]1CCN(C)[C@@H](C)C1)c1ccncc1 ZINC000160790037 539828517 /nfs/dbraw/zinc/82/85/17/539828517.db2.gz BEQPFTVOWOETFF-YCPHGPKFSA-N 0 3 289.423 2.516 20 70 CFIDHN CC[C@H](N)C(=O)N(CCc1ccc(Cl)cc1)CC1CC1 ZINC000160881593 188496446 /nfs/dbraw/zinc/49/64/46/188496446.db2.gz JKLRBMBXLDBCMY-HNNXBMFYSA-N 0 3 294.826 2.858 20 70 CFIDHN CC(C)N(CCCCS(C)(=O)=O)Cc1ccccc1 ZINC000161309873 541583329 /nfs/dbraw/zinc/58/33/29/541583329.db2.gz NGQBZCMCOQUBHX-UHFFFAOYSA-N 0 3 283.437 2.722 20 70 CFIDHN CCC[C@@H](N)C(=O)N1CCC[C@](C)(c2ccccc2)C1 ZINC000160104841 378748283 /nfs/dbraw/zinc/74/82/83/378748283.db2.gz IBZDURDEMMPUNE-WBVHZDCISA-N 0 3 274.408 2.694 20 70 CFIDHN CC(C)C[C@H](NCCCN1CCCC1=O)c1ccccn1 ZINC000159476082 378712518 /nfs/dbraw/zinc/71/25/18/378712518.db2.gz PNSHEXIIGLLMIC-INIZCTEOSA-N 0 3 289.423 2.771 20 70 CFIDHN CC(C)N1CC[C@H](N[C@@H]2CCCc3cc(F)ccc32)C1=O ZINC000159543364 378715441 /nfs/dbraw/zinc/71/54/41/378715441.db2.gz XUNMKYKPQAKHTN-CVEARBPZSA-N 0 3 290.382 2.802 20 70 CFIDHN Cc1ccc([C@H](C)CNC(=O)[C@@H](N)CC(C)C)cc1 ZINC000159655721 378723415 /nfs/dbraw/zinc/72/34/15/378723415.db2.gz RYIRGXQOUSHHCB-HIFRSBDPSA-N 0 3 262.397 2.588 20 70 CFIDHN C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)[C@@H](N)C(C)(C)C ZINC000159803086 378730471 /nfs/dbraw/zinc/73/04/71/378730471.db2.gz FRONBGOBJUXJHC-UXIGCNINSA-N 0 3 292.398 2.904 20 70 CFIDHN CCc1ncnc(N2CCC[C@H]2CN2CCCCC2)c1F ZINC000160458644 378774612 /nfs/dbraw/zinc/77/46/12/378774612.db2.gz LTLGABITVKUJDR-ZDUSSCGKSA-N 0 3 292.402 2.633 20 70 CFIDHN CCc1nnc(CN[C@@H](C)[C@@H](C)c2ccccc2)[nH]1 ZINC000160563302 378782851 /nfs/dbraw/zinc/78/28/51/378782851.db2.gz BICDJGAHAHBNRZ-NEPJUHHUSA-N 0 3 258.369 2.649 20 70 CFIDHN CCc1nnc(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)[n-]1 ZINC000160563302 378782858 /nfs/dbraw/zinc/78/28/58/378782858.db2.gz BICDJGAHAHBNRZ-NEPJUHHUSA-N 0 3 258.369 2.649 20 70 CFIDHN CC[C@H](NCCNC(=O)c1ccco1)c1ccc(F)cc1 ZINC000160712499 378792884 /nfs/dbraw/zinc/79/28/84/378792884.db2.gz HAUYRKWPIMHGPN-AWEZNQCLSA-N 0 3 290.338 2.889 20 70 CFIDHN COc1ccc(CN2CC[C@@]3(O)CCCC[C@@H]3C2)cc1F ZINC000160792653 378797883 /nfs/dbraw/zinc/79/78/83/378797883.db2.gz LXPJNFHYPDDURP-PBHICJAKSA-N 0 3 293.382 2.961 20 70 CFIDHN CC[C@@H](Cc1ccc(C)cc1)N(C)CC(OC)OC ZINC000161281250 378836178 /nfs/dbraw/zinc/83/61/78/378836178.db2.gz OXVWPBOJGLBHJO-HNNXBMFYSA-N 0 3 265.397 2.867 20 70 CFIDHN CSCC[C@@H](N)C(=O)N[C@@H](C)c1cccc(C)c1C ZINC000160836258 378801766 /nfs/dbraw/zinc/80/17/66/378801766.db2.gz KDGUEAASHOPHBJ-GXTWGEPZSA-N 0 3 280.437 2.561 20 70 CFIDHN CC(C)C1(CNC(=O)[C@@H](C)[C@H](N)c2ccccc2)CC1 ZINC000160818634 378802248 /nfs/dbraw/zinc/80/22/48/378802248.db2.gz DYXCPGKMKJBJPT-ZFWWWQNUSA-N 0 3 274.408 2.875 20 70 CFIDHN CCN(CC)C(=O)C[C@H](C)NCc1ccc(C)s1 ZINC000160938222 378812201 /nfs/dbraw/zinc/81/22/01/378812201.db2.gz FUUOGSXDOTUTRU-NSHDSACASA-N 0 3 268.426 2.793 20 70 CFIDHN CCCn1ccc2ccc(NC(=O)[C@@H](N)CC)cc21 ZINC000161281936 378835345 /nfs/dbraw/zinc/83/53/45/378835345.db2.gz COOYHTQYOCWACG-ZDUSSCGKSA-N 0 3 259.353 2.727 20 70 CFIDHN COc1ccc(CNC(C)(C)[C@H](C)O)cc1OC(F)F ZINC000161123943 378822744 /nfs/dbraw/zinc/82/27/44/378822744.db2.gz LZXJCHUIUBYMFG-VIFPVBQESA-N 0 3 289.322 2.546 20 70 CFIDHN CC1(C)Cc2cccc(CNCCSCCCO)c2O1 ZINC000217801796 382788070 /nfs/dbraw/zinc/78/80/70/382788070.db2.gz YZEXIIJVXJBROC-UHFFFAOYSA-N 0 3 295.448 2.605 20 70 CFIDHN C[C@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccccc1 ZINC000218461045 382790340 /nfs/dbraw/zinc/79/03/40/382790340.db2.gz HKPUMDHSXFAMIP-ZFWWWQNUSA-N 0 3 281.421 2.629 20 70 CFIDHN CC1CCN(CCNC(=O)[C@@H]2CCC[C@@H](C)C2)CC1 ZINC000160552942 394366380 /nfs/dbraw/zinc/36/63/80/394366380.db2.gz ODIYJYDJYYXVGV-HUUCEWRRSA-N 0 3 266.429 2.661 20 70 CFIDHN CC(C)(O)CN[C@@H]1CCCOc2c(Cl)cccc21 ZINC000160603080 394366798 /nfs/dbraw/zinc/36/67/98/394366798.db2.gz NVFKHOBVXZFZTN-GFCCVEGCSA-N 0 3 269.772 2.914 20 70 CFIDHN CC(C)c1ccc(N(C)C(=O)CNC[C@@H]2CCCO2)cc1 ZINC000161458446 276053911 /nfs/dbraw/zinc/05/39/11/276053911.db2.gz FAJSHTBRDXBNID-INIZCTEOSA-N 0 3 290.407 2.541 20 70 CFIDHN CSC[C@@H](CCO)N[C@H]1CCc2cc(F)ccc21 ZINC000160153868 278134343 /nfs/dbraw/zinc/13/43/43/278134343.db2.gz NUJQIVGMGSUYQN-OCCSQVGLSA-N 0 3 269.385 2.517 20 70 CFIDHN CC[C@H](N)C(=O)N1CCSC[C@H]1c1ccc(Cl)cc1 ZINC000161011396 280874364 /nfs/dbraw/zinc/87/43/64/280874364.db2.gz HXJPNKXXHWANMM-STQMWFEESA-N 0 3 298.839 2.694 20 70 CFIDHN Cc1ncc([C@@H](C)N[C@@H]2CCCSC2)c(C)n1 ZINC000159562305 293603849 /nfs/dbraw/zinc/60/38/49/293603849.db2.gz RCDLUEWKRDQYKV-ZYHUDNBSSA-N 0 3 251.399 2.640 20 70 CFIDHN CCc1ccc([C@H](CNC(=O)C2(C)CC2)N(C)C)cc1 ZINC000159652292 322325755 /nfs/dbraw/zinc/32/57/55/322325755.db2.gz ZUBLWMWIXPDIOU-HNNXBMFYSA-N 0 3 274.408 2.768 20 70 CFIDHN C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCC1(C2CC2)CC1 ZINC000159751137 322327349 /nfs/dbraw/zinc/32/73/49/322327349.db2.gz ZOQWXVRNKGTVLZ-UONOGXRCSA-N 0 3 293.455 2.596 20 70 CFIDHN CC(C)c1ccc(CC2CCN([C@H](C)C(N)=O)CC2)cc1 ZINC000159950460 322331136 /nfs/dbraw/zinc/33/11/36/322331136.db2.gz LYXNLDHCOJLDIC-CQSZACIVSA-N 0 3 288.435 2.938 20 70 CFIDHN CN1CCC(NC(=O)C[C@H]2CCCC(C)(C)C2)CC1 ZINC000160243768 322335193 /nfs/dbraw/zinc/33/51/93/322335193.db2.gz BDZCMGIEYCOBHP-CYBMUJFWSA-N 0 3 266.429 2.803 20 70 CFIDHN C[C@H](C(=O)NCCC1=CCCC1)N1CCCCCC1 ZINC000160233676 322335255 /nfs/dbraw/zinc/33/52/55/322335255.db2.gz QSJKJNLWWKASSB-CQSZACIVSA-N 0 3 264.413 2.868 20 70 CFIDHN Brc1cncc(CNC[C@@H]2CCCS2)c1 ZINC000160589092 518230729 /nfs/dbraw/zinc/23/07/29/518230729.db2.gz GHOSFXCHXRUZDF-NSHDSACASA-N 0 3 287.226 2.829 20 70 CFIDHN CCOC[C@@H]1CCCN(Cc2cnc3ccccn23)C1 ZINC000160410874 520115892 /nfs/dbraw/zinc/11/58/92/520115892.db2.gz ACWFKFZXCKRKFC-CQSZACIVSA-N 0 3 273.380 2.583 20 70 CFIDHN CCO[C@@H]1C[C@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160569797 520407848 /nfs/dbraw/zinc/40/78/48/520407848.db2.gz AGFVRXUSVUMGFY-LSDHHAIUSA-N 0 3 287.407 2.970 20 70 CFIDHN CCO[C@H]1C[C@@H](NCc2cnn3ccccc23)C1(C)C ZINC000217871331 520549527 /nfs/dbraw/zinc/54/95/27/520549527.db2.gz GGKBAJIKXNLARV-CABCVRRESA-N 0 3 273.380 2.628 20 70 CFIDHN CCO[C@H]1C[C@H](NCc2cc(OC)ccc2OC)C1(C)C ZINC000217893916 520576123 /nfs/dbraw/zinc/57/61/23/520576123.db2.gz NTRVHCLJYIFGES-HOTGVXAUSA-N 0 3 293.407 2.997 20 70 CFIDHN CCCCSCCC(=O)NCCN1CCC[C@H](C)C1 ZINC000159900683 520950005 /nfs/dbraw/zinc/95/00/05/520950005.db2.gz XGSOTPATMHBLMV-AWEZNQCLSA-N 0 3 286.485 2.758 20 70 CFIDHN CCOc1ccc([C@@H](C)N[C@@H](CCO)CSC)cc1 ZINC000160403831 521227232 /nfs/dbraw/zinc/22/72/32/521227232.db2.gz GARFCEFOFIUSCH-OCCSQVGLSA-N 0 3 283.437 2.850 20 70 CFIDHN CO[C@@]1(C)C[C@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160899500 523813426 /nfs/dbraw/zinc/81/34/26/523813426.db2.gz GRVSLKZOXLOPRS-YOEHRIQHSA-N 0 3 287.407 2.970 20 70 CFIDHN Cc1cccc([C@@H](C)N[C@H](C)C(=O)NCC(F)(F)F)c1 ZINC000159837811 524832355 /nfs/dbraw/zinc/83/23/55/524832355.db2.gz APAYRXPDPBPQEB-GHMZBOCLSA-N 0 3 288.313 2.713 20 70 CFIDHN Cc1cccc([C@H]2CCCN2C[C@H](O)COCC(C)C)n1 ZINC000160111448 524894522 /nfs/dbraw/zinc/89/45/22/524894522.db2.gz GZYOVYZHTVKBKN-DOTOQJQBSA-N 0 3 292.423 2.560 20 70 CFIDHN C[C@@H]1CN(C)CC[C@@H]1N(C)c1nc(C(C)(C)C)ns1 ZINC000159860698 524896138 /nfs/dbraw/zinc/89/61/38/524896138.db2.gz RJMZSMQZZUPTIL-MNOVXSKESA-N 0 3 282.457 2.612 20 70 CFIDHN Cc1nn(C)c(C)c1CNCc1cccc2cc[nH]c21 ZINC000218172017 527637098 /nfs/dbraw/zinc/63/70/98/527637098.db2.gz JLIMFHIFNFQCRF-UHFFFAOYSA-N 0 3 268.364 2.808 20 70 CFIDHN CC[C@@H]1CCC[C@@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159596506 529310062 /nfs/dbraw/zinc/31/00/62/529310062.db2.gz QJDQYFWSHDUCDD-KGLIPLIRSA-N 0 3 269.433 2.547 20 70 CFIDHN CC[C@@H](C)C[C@@H](C)NC(=O)N1CCCN(CC)CC1 ZINC000159919930 529333350 /nfs/dbraw/zinc/33/33/50/529333350.db2.gz YATOMHLFGCRKBE-ZIAGYGMSSA-N 0 3 269.433 2.548 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(C)cc1)CC2 ZINC000160547901 282126995 /nfs/dbraw/zinc/12/69/95/282126995.db2.gz WIWBNOMEQAFQGQ-IUODEOHRSA-N 0 3 270.380 2.561 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)N1CCc2ccccc21 ZINC000159679470 348014020 /nfs/dbraw/zinc/01/40/20/348014020.db2.gz NZCXUCKPSRPHRA-HOCLYGCPSA-N 0 3 284.403 2.840 20 70 CFIDHN CCN1CCCC[C@@H]1CNC(=O)CCC(C)(C)C ZINC000159765333 348014035 /nfs/dbraw/zinc/01/40/35/348014035.db2.gz YQLNXBRPKLVDKB-CYBMUJFWSA-N 0 3 254.418 2.803 20 70 CFIDHN CCN1CCCC[C@H]1CNC(=O)CCC(C)(C)C ZINC000159765481 348014422 /nfs/dbraw/zinc/01/44/22/348014422.db2.gz YQLNXBRPKLVDKB-ZDUSSCGKSA-N 0 3 254.418 2.803 20 70 CFIDHN CCN1CCCC[C@H]1CNC(=O)[C@@H](C)c1ccsc1 ZINC000159770357 348014454 /nfs/dbraw/zinc/01/44/54/348014454.db2.gz SJWLVQRQELUKBZ-JSGCOSHPSA-N 0 3 280.437 2.842 20 70 CFIDHN CCCCN(C)CCNC(=O)[C@H](C)Cc1ccccc1F ZINC000159951536 348015338 /nfs/dbraw/zinc/01/53/38/348015338.db2.gz PFAQKNLXKKNLSB-CQSZACIVSA-N 0 3 294.414 2.852 20 70 CFIDHN C[C@H](NCC1C2CC3CC(C2)CC1C3)c1nncn1C ZINC000216824590 539624065 /nfs/dbraw/zinc/62/40/65/539624065.db2.gz ZMSJQRNMZDZVHZ-GFSREQAASA-N 0 3 274.412 2.538 20 70 CFIDHN CCO[C@H]1CCCN(Cc2c(C)nc3ccccn32)C1 ZINC000160528670 541431844 /nfs/dbraw/zinc/43/18/44/541431844.db2.gz DVLADUOVBUAMRE-AWEZNQCLSA-N 0 3 273.380 2.644 20 70 CFIDHN C[C@@H](NC1CCN(C(=O)c2ccco2)CC1)c1ccco1 ZINC000160224394 378757730 /nfs/dbraw/zinc/75/77/30/378757730.db2.gz RUNXYMQBZWQZJN-GFCCVEGCSA-N 0 3 288.347 2.828 20 70 CFIDHN CCC[C@H](N)C(=O)N1CCC[C@@](C)(c2ccccc2)C1 ZINC000160104447 378748082 /nfs/dbraw/zinc/74/80/82/378748082.db2.gz IBZDURDEMMPUNE-DOTOQJQBSA-N 0 3 274.408 2.694 20 70 CFIDHN OCC1(NCc2ccc(F)c(C(F)(F)F)c2)CCC1 ZINC000160160275 378752385 /nfs/dbraw/zinc/75/23/85/378752385.db2.gz BESVDYDTJYYBEM-UHFFFAOYSA-N 0 3 277.261 2.849 20 70 CFIDHN CCOC1CC(Nc2ccc(OCCN(C)C)cc2)C1 ZINC000160156210 378752585 /nfs/dbraw/zinc/75/25/85/378752585.db2.gz JTQHRGUGKRFWJH-UHFFFAOYSA-N 0 3 278.396 2.606 20 70 CFIDHN COc1ccccc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000159657461 378723558 /nfs/dbraw/zinc/72/35/58/378723558.db2.gz IIMUARZOOYYOEX-IMJJTQAJSA-N 0 3 273.376 2.742 20 70 CFIDHN C[C@@H](NC1CCN(C(=O)c2ccoc2)CC1)c1ccco1 ZINC000160198826 378756424 /nfs/dbraw/zinc/75/64/24/378756424.db2.gz JUNQQDFPKUFGIV-GFCCVEGCSA-N 0 3 288.347 2.828 20 70 CFIDHN CCN1CCCC[C@@H]1CNC(=O)[C@@H](C)c1cccs1 ZINC000159769660 378728591 /nfs/dbraw/zinc/72/85/91/378728591.db2.gz PRMAULQQNISJRA-QWHCGFSZSA-N 0 3 280.437 2.842 20 70 CFIDHN Fc1cccc(CN(CCn2ccnc2)C2CC2)c1 ZINC000159762573 378729331 /nfs/dbraw/zinc/72/93/31/378729331.db2.gz OJIQIFLQZNBOEO-UHFFFAOYSA-N 0 3 259.328 2.687 20 70 CFIDHN C[C@@H](CN[C@@H](C)c1cnn(C)c1)N1CCc2ccccc2C1 ZINC000159809008 378731625 /nfs/dbraw/zinc/73/16/25/378731625.db2.gz DWCYNWDWOZWLKH-GJZGRUSLSA-N 0 3 298.434 2.518 20 70 CFIDHN CSC[C@@H](CCO)N[C@H]1CCCOc2ccc(C)cc21 ZINC000160275984 378760538 /nfs/dbraw/zinc/76/05/38/378760538.db2.gz JDKKXKGZPVVZEI-HIFRSBDPSA-N 0 3 295.448 2.912 20 70 CFIDHN CC(C)[C@@H](C(=O)N[C@H]1CCCc2sccc21)N(C)C ZINC000160265149 378760723 /nfs/dbraw/zinc/76/07/23/378760723.db2.gz LEVGHOCHFRXUQY-JSGCOSHPSA-N 0 3 280.437 2.828 20 70 CFIDHN COc1cccc(CN2CC[C@@]3(O)CCCC[C@@H]3C2)c1 ZINC000160795351 378799615 /nfs/dbraw/zinc/79/96/15/378799615.db2.gz DGRQNTBPMNIDNF-WBVHZDCISA-N 0 3 275.392 2.822 20 70 CFIDHN CC(C)OC(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000160328558 378764188 /nfs/dbraw/zinc/76/41/88/378764188.db2.gz DUDVPIGAOGZOGZ-UHFFFAOYSA-N 0 3 276.380 2.786 20 70 CFIDHN C[C@@H](O)C(C)(C)NCc1cc(Br)cs1 ZINC000160618751 378786076 /nfs/dbraw/zinc/78/60/76/378786076.db2.gz SKSWLNLKNMONCN-SSDOTTSWSA-N 0 3 278.215 2.760 20 70 CFIDHN COC(CN(C)CCCOc1ccc(Cl)cc1)OC ZINC000160640922 378787330 /nfs/dbraw/zinc/78/73/30/378787330.db2.gz BTPXHSHGWDNMHB-UHFFFAOYSA-N 0 3 287.787 2.660 20 70 CFIDHN C[C@@H](NCC(C)(C)O)c1ccc(F)cc1OC(F)F ZINC000160650779 378789636 /nfs/dbraw/zinc/78/96/36/378789636.db2.gz GOVPIJSXJWAQOC-MRVPVSSYSA-N 0 3 277.286 2.849 20 70 CFIDHN CC(C)COCCN[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000160704387 378793618 /nfs/dbraw/zinc/79/36/18/378793618.db2.gz ARKIENYFKGLQCJ-YJYMSZOUSA-N 0 3 283.437 2.747 20 70 CFIDHN Cc1ccc([C@H](C)CN[C@H](C(N)=O)c2ccccc2)cc1 ZINC000161051302 378817668 /nfs/dbraw/zinc/81/76/68/378817668.db2.gz XLARHNCQQOPUAI-PBHICJAKSA-N 0 3 282.387 2.915 20 70 CFIDHN CC(C)(C)Cc1cc(NC(=O)C2(N)CCCCC2)n[nH]1 ZINC000161049534 378817856 /nfs/dbraw/zinc/81/78/56/378817856.db2.gz WBBGIJQVIUSBLN-UHFFFAOYSA-N 0 3 278.400 2.598 20 70 CFIDHN COc1ccc(CNC(C)(C)[C@H](C)O)c(Cl)c1OC ZINC000161129919 378824649 /nfs/dbraw/zinc/82/46/49/378824649.db2.gz HRDOLZQFRLQRCA-VIFPVBQESA-N 0 3 287.787 2.606 20 70 CFIDHN CC[C@H](COC)NCc1cccc(C(=O)N[C@@H](C)CC)c1 ZINC000161136200 378825042 /nfs/dbraw/zinc/82/50/42/378825042.db2.gz LIDAHZLXTGUPEB-XJKSGUPXSA-N 0 3 292.423 2.730 20 70 CFIDHN CCC[C@H](C(=O)N[C@@H]1CCc2ccccc21)N(C)C ZINC000161346193 378840535 /nfs/dbraw/zinc/84/05/35/378840535.db2.gz SOAOSLCAZKTZQQ-HUUCEWRRSA-N 0 3 260.381 2.520 20 70 CFIDHN Cc1noc(C)c1CCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000161340666 378840655 /nfs/dbraw/zinc/84/06/55/378840655.db2.gz BKENLGMKWOESLQ-GOSISDBHSA-N 0 3 299.418 2.823 20 70 CFIDHN Cc1ncc([C@@H](C)NC[C@H](CO)c2ccccc2)c(C)n1 ZINC000161469741 378849364 /nfs/dbraw/zinc/84/93/64/378849364.db2.gz KVGFVHFLAOLTLI-MLGOLLRUSA-N 0 3 285.391 2.520 20 70 CFIDHN CN(C[C@@H](O)c1cc2ccccc2o1)C[C@@H]1CCCCO1 ZINC000216951755 382785343 /nfs/dbraw/zinc/78/53/43/382785343.db2.gz ARGXHXHMTIBFAX-LSDHHAIUSA-N 0 3 289.375 2.967 20 70 CFIDHN CC(C)[C@@H](CNCc1nccn1C)c1ccccc1 ZINC000218233720 382790083 /nfs/dbraw/zinc/79/00/83/382790083.db2.gz HFDNWKKCJACPKT-OAHLLOKOSA-N 0 3 257.381 2.950 20 70 CFIDHN COc1ccc([C@@H]2CCN(CCOCC3CC3)C2)cc1 ZINC000160032500 533145611 /nfs/dbraw/zinc/14/56/11/533145611.db2.gz SUCLLBVUBVYHDL-MRXNPFEDSA-N 0 3 275.392 2.911 20 70 CFIDHN CC[C@H](C)[C@H](N)C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000160344702 394366633 /nfs/dbraw/zinc/36/66/33/394366633.db2.gz QTJYJCOCLKCQCT-LNSITVRQSA-N 0 3 290.407 2.778 20 70 CFIDHN CCO[C@H]1C[C@@H](NC(=O)[C@@H](N)C(C)(C)C)C12CCCCC2 ZINC000161179501 286483832 /nfs/dbraw/zinc/48/38/32/286483832.db2.gz YXSFAJOTXUTJJU-HZSPNIEDSA-N 0 3 296.455 2.604 20 70 CFIDHN CCN(CC)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000159848721 276091149 /nfs/dbraw/zinc/09/11/49/276091149.db2.gz MMDAROKOPLTGSQ-ZBFHGGJFSA-N 0 3 289.423 2.701 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H]2C[C@@H]2C2CCCCC2)CC1 ZINC000159908808 276162390 /nfs/dbraw/zinc/16/23/90/276162390.db2.gz RKTGLLNPDOZQNJ-HZPDHXFCSA-N 0 3 293.455 2.692 20 70 CFIDHN Cc1ccccc1[C@H](NC(=O)CN)[C@H]1CCC[C@H](C)C1 ZINC000159687209 292683021 /nfs/dbraw/zinc/68/30/21/292683021.db2.gz MUNNBBIPPSJSMX-RVSPLBMKSA-N 0 3 274.408 2.937 20 70 CFIDHN CCC[C@@H](N[C@H]1CCN(C(=O)CC)C1)c1ccccn1 ZINC000159385220 322322178 /nfs/dbraw/zinc/32/21/78/322322178.db2.gz LWUQCZVCZLYPCA-DZGCQCFKSA-N 0 3 275.396 2.523 20 70 CFIDHN CC(C)C[C@H](C)NC(=O)N[C@H](C)CN1CCCCC1 ZINC000159611481 322325007 /nfs/dbraw/zinc/32/50/07/322325007.db2.gz PFVPNUFTEFNBRW-UONOGXRCSA-N 0 3 269.433 2.595 20 70 CFIDHN Cc1csc([C@H](NCCC(C)(C)O)C2CC2)n1 ZINC000159614353 322325020 /nfs/dbraw/zinc/32/50/20/322325020.db2.gz AXJMRGMVPRREKI-LLVKDONJSA-N 0 3 254.399 2.653 20 70 CFIDHN C[C@H](CN[C@@H](C)c1cnccn1)N1CCc2ccccc2C1 ZINC000159806937 322328685 /nfs/dbraw/zinc/32/86/85/322328685.db2.gz CGSUFVRILURWSX-CABCVRRESA-N 0 3 296.418 2.574 20 70 CFIDHN C[C@@H](N[C@H]1CCN(CC(F)(F)F)C1)c1ccco1 ZINC000160223593 322334886 /nfs/dbraw/zinc/33/48/86/322334886.db2.gz XKPGSONTIPYUOF-ZJUUUORDSA-N 0 3 262.275 2.567 20 70 CFIDHN CCCN(CCO)Cc1ccc(OC)c(OCC(C)C)c1 ZINC000161193468 322348635 /nfs/dbraw/zinc/34/86/35/322348635.db2.gz CINCMXGESUNNCW-UHFFFAOYSA-N 0 3 295.423 2.934 20 70 CFIDHN COc1ccc([C@@H](C)N[C@H]2CCC(=O)N(C)C2)cc1Cl ZINC000161204202 322348718 /nfs/dbraw/zinc/34/87/18/322348718.db2.gz MQXWJWHRDCRHHY-PWSUYJOCSA-N 0 3 296.798 2.620 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H](C)C2CCCCC2)CC1 ZINC000159901324 521607716 /nfs/dbraw/zinc/60/77/16/521607716.db2.gz PYBXXKXKSFHQBS-AWEZNQCLSA-N 0 3 281.444 2.692 20 70 CFIDHN CCSCc1cccc(NC(=O)[C@@H](N)CCSC)c1 ZINC000161481807 521718567 /nfs/dbraw/zinc/71/85/67/521718567.db2.gz QZUQZNFILAGNDM-ZDUSSCGKSA-N 0 3 298.477 2.959 20 70 CFIDHN COc1ccc(CNC[C@H]2CCC(C)(C)O2)c(OC)c1 ZINC000160288412 524072132 /nfs/dbraw/zinc/07/21/32/524072132.db2.gz NFPFMSZSAACDIX-CQSZACIVSA-N 0 3 279.380 2.751 20 70 CFIDHN Cc1cccc([C@H](C)CNC(=O)[C@@H](N)CC(C)C)c1 ZINC000160738310 524866327 /nfs/dbraw/zinc/86/63/27/524866327.db2.gz KCMHFOKCLFCNNJ-HIFRSBDPSA-N 0 3 262.397 2.588 20 70 CFIDHN COc1ccc([C@@H](C)N(C)CCn2ccnc2)cc1 ZINC000161354970 525128770 /nfs/dbraw/zinc/12/87/70/525128770.db2.gz STCWIBWXQHEQAQ-CYBMUJFWSA-N 0 3 259.353 2.585 20 70 CFIDHN CSCCCCC(=O)N[C@@H](C)CN1CCCCC1 ZINC000159755748 525403391 /nfs/dbraw/zinc/40/33/91/525403391.db2.gz BKMVGXFXTDCXCW-ZDUSSCGKSA-N 0 3 272.458 2.510 20 70 CFIDHN c1ccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)cc1 ZINC000161407267 526470691 /nfs/dbraw/zinc/47/06/91/526470691.db2.gz HCBYBWIRPKPORN-HNNXBMFYSA-N 0 3 282.391 2.604 20 70 CFIDHN N[C@H](CC(=O)N[C@H]1C[C@@H]1c1ccccc1)c1ccccc1 ZINC000217771761 527384063 /nfs/dbraw/zinc/38/40/63/527384063.db2.gz LTWCAHXTYCCMJK-ZACQAIPSSA-N 0 3 280.371 2.749 20 70 CFIDHN C(CN1CCC(OC2CCCC2)CC1)OCC1CC1 ZINC000159976264 527478484 /nfs/dbraw/zinc/47/84/84/527478484.db2.gz IHABYVLMXAWUFR-UHFFFAOYSA-N 0 3 267.413 2.837 20 70 CFIDHN CCOCCCN1CCC[C@H](c2nccs2)C1 ZINC000160004622 528659946 /nfs/dbraw/zinc/65/99/46/528659946.db2.gz GAGWZCIVCNNJMQ-LBPRGKRZSA-N 0 3 254.399 2.749 20 70 CFIDHN CN(C(=O)CN1CC[C@@H]2CCCC[C@@H]21)c1ccccc1 ZINC000159682865 348014186 /nfs/dbraw/zinc/01/41/86/348014186.db2.gz KVYQRBOSHHYKTP-HOCLYGCPSA-N 0 3 272.392 2.914 20 70 CFIDHN CCN(C(=O)N[C@@H]1CCN(CC2CC2)C1)[C@@H](C)C(C)C ZINC000160758125 348020787 /nfs/dbraw/zinc/02/07/87/348020787.db2.gz MPMATAHIOSAYOW-DZGCQCFKSA-N 0 3 281.444 2.547 20 70 CFIDHN CCOc1ccc([C@H](CC)NCCO)cc1OCC ZINC000159713701 188438680 /nfs/dbraw/zinc/43/86/80/188438680.db2.gz AAARFUYTEXAXAM-ZDUSSCGKSA-N 0 3 267.369 2.517 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000161054828 188504984 /nfs/dbraw/zinc/50/49/84/188504984.db2.gz TYMSFHKSOZJNNX-BZUAXINKSA-N 0 3 274.408 2.641 20 70 CFIDHN Cc1ccc([C@H](C)CN[C@@H](C(N)=O)c2ccccc2)cc1 ZINC000161051526 188505672 /nfs/dbraw/zinc/50/56/72/188505672.db2.gz XLARHNCQQOPUAI-RHSMWYFYSA-N 0 3 282.387 2.915 20 70 CFIDHN CCCn1nccc1CNCCCOc1ccccc1 ZINC000160133877 540669391 /nfs/dbraw/zinc/66/93/91/540669391.db2.gz BIIARLJXTSJEAR-UHFFFAOYSA-N 0 3 273.380 2.852 20 70 CFIDHN CC1(C)CNCCN1C(=O)c1cc2ccc(F)cc2s1 ZINC000161208455 540690632 /nfs/dbraw/zinc/69/06/32/540690632.db2.gz LMGZLJFXKYEUGQ-UHFFFAOYSA-N 0 3 292.379 2.864 20 70 CFIDHN C[C@@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159386507 540991879 /nfs/dbraw/zinc/99/18/79/540991879.db2.gz IJHOBHKXTZMPJI-UKRRQHHQSA-N 0 3 287.407 2.523 20 70 CFIDHN C[C@H](CC(=O)N(C)[C@H]1CCN(C)[C@H](C)C1)c1ccncc1 ZINC000160789901 541480075 /nfs/dbraw/zinc/48/00/75/541480075.db2.gz BEQPFTVOWOETFF-FMKPAKJESA-N 0 3 289.423 2.516 20 70 CFIDHN CC(C)N(C)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C ZINC000159948342 378738516 /nfs/dbraw/zinc/73/85/16/378738516.db2.gz WBIRLSUHELLBMQ-ZBFHGGJFSA-N 0 3 289.423 2.557 20 70 CFIDHN C[C@@H](CN[C@@H](C)c1cnn(C)c1)N1CCc2ccccc21 ZINC000159920721 378738604 /nfs/dbraw/zinc/73/86/04/378738604.db2.gz OZFNHOQQWRUWDT-KBPBESRZSA-N 0 3 284.407 2.522 20 70 CFIDHN CCC[C@H](N)C(=O)N1CCC[C@](C)(c2ccccc2)C1 ZINC000160104704 378748449 /nfs/dbraw/zinc/74/84/49/378748449.db2.gz IBZDURDEMMPUNE-RDJZCZTQSA-N 0 3 274.408 2.694 20 70 CFIDHN CCN(CCc1nccs1)CCc1ccccn1 ZINC000159388340 378707103 /nfs/dbraw/zinc/70/71/03/378707103.db2.gz VKNGVGYIVMOMBI-UHFFFAOYSA-N 0 3 261.394 2.645 20 70 CFIDHN C[C@H](O)CN(C)[C@@H](C)c1cccc(Br)c1 ZINC000159399401 378707378 /nfs/dbraw/zinc/70/73/78/378707378.db2.gz BWSOHOQKCFZZLB-UWVGGRQHSA-N 0 3 272.186 2.823 20 70 CFIDHN CCc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)o1 ZINC000159595936 378719050 /nfs/dbraw/zinc/71/90/50/378719050.db2.gz XXPZYUMOZCROQU-KFWWJZLASA-N 0 3 261.365 2.889 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC([C@@H](C)O)CC2)cc1 ZINC000159618872 378720181 /nfs/dbraw/zinc/72/01/81/378720181.db2.gz QLCNLJQHZPPVAT-CQSZACIVSA-N 0 3 275.392 2.661 20 70 CFIDHN Cc1ccccc1[C@H](NC(=O)CN)[C@@H]1CCC[C@H](C)C1 ZINC000159686946 378724543 /nfs/dbraw/zinc/72/45/43/378724543.db2.gz MUNNBBIPPSJSMX-DXCKQFNASA-N 0 3 274.408 2.937 20 70 CFIDHN O=C(N[C@H]1CCC[C@H]1c1ccccc1)[C@@H]1CCCCN1 ZINC000159712153 378725836 /nfs/dbraw/zinc/72/58/36/378725836.db2.gz NUCKGCZHXGUACW-JYJNAYRXSA-N 0 3 272.392 2.581 20 70 CFIDHN C[C@H](N[C@@H](CC(N)=O)C1CCCCC1)c1ccccn1 ZINC000159751611 378728853 /nfs/dbraw/zinc/72/88/53/378728853.db2.gz KZDKMIQYLKWEBO-WFASDCNBSA-N 0 3 275.396 2.557 20 70 CFIDHN CCc1ccc(/C=C/C(=O)N(C)[C@H]2CCN(C)[C@H](C)C2)o1 ZINC000160421816 378771516 /nfs/dbraw/zinc/77/15/16/378771516.db2.gz YTPASTQOPFHZDV-VRZZLATASA-N 0 3 290.407 2.796 20 70 CFIDHN CCc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)s1 ZINC000160559477 378782107 /nfs/dbraw/zinc/78/21/07/378782107.db2.gz XGBVGMAGNYDWBC-CMPLNLGQSA-N 0 3 290.436 2.876 20 70 CFIDHN C[C@H](O)C(C)(C)NCc1csc(Br)c1 ZINC000160620413 378786675 /nfs/dbraw/zinc/78/66/75/378786675.db2.gz TYKUKHVIIPDCDP-ZETCQYMHSA-N 0 3 278.215 2.760 20 70 CFIDHN CCc1ccc([C@@H](C)NCC(=O)NCC(F)(F)F)s1 ZINC000160618880 378786753 /nfs/dbraw/zinc/78/67/53/378786753.db2.gz FWPSDFRPEVOYEN-MRVPVSSYSA-N 0 3 294.342 2.640 20 70 CFIDHN CCCN(CCO)Cc1ccc(OC)cc1OC(F)F ZINC000161203145 378831556 /nfs/dbraw/zinc/83/15/56/378831556.db2.gz PXDZWQHFJAJTAQ-UHFFFAOYSA-N 0 3 289.322 2.501 20 70 CFIDHN CSCC[C@@H](N)C(=O)N[C@H](C)c1cccc(C)c1C ZINC000160836124 378802750 /nfs/dbraw/zinc/80/27/50/378802750.db2.gz KDGUEAASHOPHBJ-TZMCWYRMSA-N 0 3 280.437 2.561 20 70 CFIDHN C[C@H](C(=O)N1CCCNCC1)c1ccc2ccccc2c1 ZINC000160871261 378806496 /nfs/dbraw/zinc/80/64/96/378806496.db2.gz OYOFMBMZIZKFIE-AWEZNQCLSA-N 0 3 282.387 2.765 20 70 CFIDHN CC[C@@H](N[C@@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1 ZINC000160928542 378809164 /nfs/dbraw/zinc/80/91/64/378809164.db2.gz YPAJHDWTYKZUIT-HUUCEWRRSA-N 0 3 278.371 2.876 20 70 CFIDHN CC(C)NC(=O)CN[C@H]1c2cccc(F)c2CC[C@H]1C ZINC000160914781 378810251 /nfs/dbraw/zinc/81/02/51/378810251.db2.gz FCUCKEVGLNOIOF-BDJLRTHQSA-N 0 3 278.371 2.563 20 70 CFIDHN CC(C)C[C@H](NCC(=O)NC(C)C)c1cccs1 ZINC000160973190 378813410 /nfs/dbraw/zinc/81/34/10/378813410.db2.gz IMXCRRSMSOBNDY-LBPRGKRZSA-N 0 3 268.426 2.950 20 70 CFIDHN CC[C@H](C(=O)N1CCC2(C1)CCCCC2)N(C)C ZINC000161086004 378819789 /nfs/dbraw/zinc/81/97/89/378819789.db2.gz RTBUFNJYGUUYOM-CYBMUJFWSA-N 0 3 252.402 2.509 20 70 CFIDHN COc1cc(CNC(C)(C)[C@H](C)O)ccc1OC(C)C ZINC000161135428 378824313 /nfs/dbraw/zinc/82/43/13/378824313.db2.gz FXZZPJRKKTVMGZ-LBPRGKRZSA-N 0 3 281.396 2.731 20 70 CFIDHN CC(C)C(=O)NCCCN[C@@H](C)c1ccccc1F ZINC000159991143 322331516 /nfs/dbraw/zinc/33/15/16/322331516.db2.gz ZULVXPYIIGBWAB-LBPRGKRZSA-N 0 3 266.360 2.639 20 70 CFIDHN C[C@@H](N[C@@H]1CCC[C@@H](C)C1)c1nnc2ccccn21 ZINC000217641629 382787194 /nfs/dbraw/zinc/78/71/94/382787194.db2.gz YBXCQDZYHAHGGO-JHJVBQTASA-N 0 3 258.369 2.959 20 70 CFIDHN C[C@@H]1CN(C[C@@H](O)c2cc3ccccc3o2)CCCO1 ZINC000217603467 382787215 /nfs/dbraw/zinc/78/72/15/382787215.db2.gz MYRORXNAGJOYDJ-TZMCWYRMSA-N 0 3 275.348 2.577 20 70 CFIDHN CC[C@H](N)C(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000160082322 394365951 /nfs/dbraw/zinc/36/59/51/394365951.db2.gz GAPFCRPCUHQPEG-QWRGUYRKSA-N 0 3 287.190 2.834 20 70 CFIDHN C[C@]1(c2ccccc2)CCCN(C(=O)[C@@H]2CCCCN2)C1 ZINC000160101517 274653362 /nfs/dbraw/zinc/65/33/62/274653362.db2.gz FMMPMSHSWKMAOQ-WMZOPIPTSA-N 0 3 286.419 2.709 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@H]1CC(C)(C)Oc2ccccc21 ZINC000161396310 276043352 /nfs/dbraw/zinc/04/33/52/276043352.db2.gz AJZYBTMNDDODME-STQMWFEESA-N 0 3 276.380 2.532 20 70 CFIDHN CC(C)c1ccc(N(C)C(=O)CNC[C@H]2CCCO2)cc1 ZINC000161458564 278038265 /nfs/dbraw/zinc/03/82/65/278038265.db2.gz FAJSHTBRDXBNID-MRXNPFEDSA-N 0 3 290.407 2.541 20 70 CFIDHN CSC[C@](C)(O)CNCc1ccccc1C(F)(F)F ZINC000217867481 278140202 /nfs/dbraw/zinc/14/02/02/278140202.db2.gz GIBOFKJKCZJCRQ-GFCCVEGCSA-N 0 3 293.354 2.909 20 70 CFIDHN C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1cc2cc(F)ccc2o1 ZINC000159521578 322324097 /nfs/dbraw/zinc/32/40/97/322324097.db2.gz YZCCIGWRBKYGJT-GHMZBOCLSA-N 0 3 290.338 2.658 20 70 CFIDHN CCN1CCC(NC(=O)[C@@H](C)OC2CCCCCC2)CC1 ZINC000159585590 322324432 /nfs/dbraw/zinc/32/44/32/322324432.db2.gz GHPOQENKKNLMJQ-CQSZACIVSA-N 0 3 296.455 2.715 20 70 CFIDHN Cc1cc(C)c(C(=O)NC[C@H](Cc2ccccc2)N(C)C)[nH]1 ZINC000159634690 322325597 /nfs/dbraw/zinc/32/55/97/322325597.db2.gz DHWUCGVHFPDCPU-INIZCTEOSA-N 0 3 299.418 2.534 20 70 CFIDHN CC[C@]1(C)C[C@@H]1C(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000160204008 322334211 /nfs/dbraw/zinc/33/42/11/322334211.db2.gz DSYWEXQFVKQXJV-HLLBOEOZSA-N 0 3 274.408 2.842 20 70 CFIDHN CCSCC[C@H](C)NC(=O)[C@H]1CNCc2ccccc21 ZINC000160208962 322334510 /nfs/dbraw/zinc/33/45/10/322334510.db2.gz WDXYFKKIUWLOSN-WFASDCNBSA-N 0 3 292.448 2.521 20 70 CFIDHN C[C@H](N[C@H]1CCN(CC(F)(F)F)C1)c1ccco1 ZINC000160223471 322334559 /nfs/dbraw/zinc/33/45/59/322334559.db2.gz XKPGSONTIPYUOF-UWVGGRQHSA-N 0 3 262.275 2.567 20 70 CFIDHN CC(C)C[C@@H](CN(C)C)NC(=O)C1CCC(F)(F)CC1 ZINC000160248509 322335339 /nfs/dbraw/zinc/33/53/39/322335339.db2.gz HPFGIUUQXIVKES-ZDUSSCGKSA-N 0 3 290.398 2.904 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@H]1CCCC[C@@H]1C ZINC000160756298 322342402 /nfs/dbraw/zinc/34/24/02/322342402.db2.gz WCHGHBCJHXZRRT-KBPBESRZSA-N 0 3 275.458 2.710 20 70 CFIDHN Cc1occc1CN(C)C(=O)c1ccc(CN(C)C)cc1 ZINC000160976465 322345334 /nfs/dbraw/zinc/34/53/34/322345334.db2.gz CMRKOLDSNJNOGV-UHFFFAOYSA-N 0 3 286.375 2.922 20 70 CFIDHN Cc1ncc([C@H](C)NCCc2ccc3c(c2)OCO3)c(C)n1 ZINC000161124238 322347454 /nfs/dbraw/zinc/34/74/54/322347454.db2.gz RBPMUWCHBJBLBR-NSHDSACASA-N 0 3 299.374 2.715 20 70 CFIDHN CCOC(=O)[C@H]1CCCCN1C[C@H]1CC=CCC1 ZINC000161250185 322349368 /nfs/dbraw/zinc/34/93/68/322349368.db2.gz ZTDGIFVAOODPKX-UONOGXRCSA-N 0 3 251.370 2.760 20 70 CFIDHN CCCCS[C@H](C)C(=O)N1CCCN(CCC)CC1 ZINC000160369542 520968655 /nfs/dbraw/zinc/96/86/55/520968655.db2.gz VVCZCYNYDWKOIH-CQSZACIVSA-N 0 3 286.485 2.853 20 70 CFIDHN CC(C)N(CCc1nccs1)C[C@@H]1CCCO1 ZINC000159873497 519651733 /nfs/dbraw/zinc/65/17/33/519651733.db2.gz SUDPLNOSACADDG-LBPRGKRZSA-N 0 3 254.399 2.575 20 70 CFIDHN CC(C)NC(=O)CN[C@@H](C)c1cccc(-c2ccncc2)c1 ZINC000161005151 519708735 /nfs/dbraw/zinc/70/87/35/519708735.db2.gz QPDRMJXPRVXPSI-AWEZNQCLSA-N 0 3 297.402 2.924 20 70 CFIDHN CC(=O)Nc1cccc([C@@H](C)NCC2(CO)CCCC2)c1 ZINC000160102566 519746964 /nfs/dbraw/zinc/74/69/64/519746964.db2.gz VLRVQOAQWUIAOP-CYBMUJFWSA-N 0 3 290.407 2.848 20 70 CFIDHN CCO[C@@H]1C[C@H](NCc2cnn3ccccc23)C1(C)C ZINC000217871429 520432811 /nfs/dbraw/zinc/43/28/11/520432811.db2.gz GGKBAJIKXNLARV-LSDHHAIUSA-N 0 3 273.380 2.628 20 70 CFIDHN CCO[C@H]1C[C@@H](NCc2cc(OC)ccc2OC)C1(C)C ZINC000217893757 520550613 /nfs/dbraw/zinc/55/06/13/520550613.db2.gz NTRVHCLJYIFGES-CVEARBPZSA-N 0 3 293.407 2.997 20 70 CFIDHN CCc1nc(Cl)c(C)c(N2CCN(CC(C)C)CC2)n1 ZINC000159681818 522375628 /nfs/dbraw/zinc/37/56/28/522375628.db2.gz GJFDVSAEYHJVEE-UHFFFAOYSA-N 0 3 296.846 2.779 20 70 CFIDHN COC[C@H]1CCCN(Cc2c(C)nc3ccccn32)C1 ZINC000160394371 522832801 /nfs/dbraw/zinc/83/28/01/522832801.db2.gz AJLRPFAGACNAQJ-AWEZNQCLSA-N 0 3 273.380 2.501 20 70 CFIDHN CCn1cc([C@H](C)NC[C@](C)(O)CCC(C)C)cn1 ZINC000159392147 523472903 /nfs/dbraw/zinc/47/29/03/523472903.db2.gz ZLHJWMYZNFIFFC-DZGCQCFKSA-N 0 3 267.417 2.741 20 70 CFIDHN CCn1nc(CNCC2(CO)CCCC2)c2ccccc21 ZINC000160138214 523675744 /nfs/dbraw/zinc/67/57/44/523675744.db2.gz MZDYAHUYNOKDJB-UHFFFAOYSA-N 0 3 287.407 2.699 20 70 CFIDHN Cc1cccc([C@@H](C)NCC(=O)NC2CCCC2)c1 ZINC000160221498 524827237 /nfs/dbraw/zinc/82/72/37/524827237.db2.gz NZWAJBJYSMOLJX-CYBMUJFWSA-N 0 3 260.381 2.704 20 70 CFIDHN C[C@@H](NCC1(CO)CCCC1)c1nc2ccccc2n1C ZINC000160096674 525422014 /nfs/dbraw/zinc/42/20/14/525422014.db2.gz WYUUXQOOIPGHRS-CYBMUJFWSA-N 0 3 287.407 2.777 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC[C@@H](C)[C@@H]2CO)cc1 ZINC000160944141 526045511 /nfs/dbraw/zinc/04/55/11/526045511.db2.gz BPRMELUYDQDIOK-ZBFHGGJFSA-N 0 3 275.392 2.661 20 70 CFIDHN OCC1(CNCc2cn3cc(Cl)ccc3n2)CCCC1 ZINC000160152348 527523665 /nfs/dbraw/zinc/52/36/65/527523665.db2.gz SWKDSXIOYMOLRZ-UHFFFAOYSA-N 0 3 293.798 2.630 20 70 CFIDHN CCN1CCCN(C(=O)NCC(CC)(CC)CC)CC1 ZINC000159983401 529023866 /nfs/dbraw/zinc/02/38/66/529023866.db2.gz KXFKNTNSGYUWMW-UHFFFAOYSA-N 0 3 283.460 2.940 20 70 CFIDHN CC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc(C)cc1 ZINC000159921441 529175203 /nfs/dbraw/zinc/17/52/03/529175203.db2.gz UHCQJQMBGZFFQX-MJBXVCDLSA-N 0 3 262.397 2.949 20 70 CFIDHN CC[C@H]1CCC[C@H](NC(=O)N2CCCN(CC)CC2)C1 ZINC000159894528 529230184 /nfs/dbraw/zinc/23/01/84/529230184.db2.gz WEJCGXJPTVUPAK-GJZGRUSLSA-N 0 3 281.444 2.692 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccccc1C)CC2 ZINC000159596925 282125976 /nfs/dbraw/zinc/12/59/76/282125976.db2.gz HZTHAJRQXJHSNO-GXTWGEPZSA-N 0 3 270.380 2.561 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1cc(C)cc(C)c1)CC2 ZINC000160304068 282126872 /nfs/dbraw/zinc/12/68/72/282126872.db2.gz WAUHNLWUTJDOFP-CZUORRHYSA-N 0 3 284.407 2.869 20 70 CFIDHN O=C(NCCCCCOC1CCCCC1)[C@H]1CCCCN1 ZINC000159533377 232244671 /nfs/dbraw/zinc/24/46/71/232244671.db2.gz CCLQKNRHVCEVNS-MRXNPFEDSA-N 0 3 296.455 2.764 20 70 CFIDHN O=C(NCCCCCOC1CCCCC1)[C@@H]1CCCCN1 ZINC000159533242 232244692 /nfs/dbraw/zinc/24/46/92/232244692.db2.gz CCLQKNRHVCEVNS-INIZCTEOSA-N 0 3 296.455 2.764 20 70 CFIDHN C[C@H](NCC1(c2ccc(F)cc2)CC1)c1cnccn1 ZINC000161359918 232252158 /nfs/dbraw/zinc/25/21/58/232252158.db2.gz FZQOVMGBVBHGAP-LBPRGKRZSA-N 0 3 271.339 2.998 20 70 CFIDHN CCc1ccc([C@@H](C)CC(=O)NC[C@H]2CCCN2C)cc1 ZINC000160134159 348015806 /nfs/dbraw/zinc/01/58/06/348015806.db2.gz KPOKJBCSPOHBPX-WMLDXEAASA-N 0 3 288.435 2.953 20 70 CFIDHN CCSCC[C@@H](C)NC(=O)c1cccc2c1CCNC2 ZINC000160217349 348017104 /nfs/dbraw/zinc/01/71/04/348017104.db2.gz JVXSQZWQVJQFIJ-GFCCVEGCSA-N 0 3 292.448 2.594 20 70 CFIDHN CCC(CC)CNC(=O)N1CCN(C2CCCC2)CC1 ZINC000160539344 348019041 /nfs/dbraw/zinc/01/90/41/348019041.db2.gz GFRZOIASOWCZQK-UHFFFAOYSA-N 0 3 281.444 2.692 20 70 CFIDHN CC[C@@H]1CCCN(C(=O)N[C@H]2CCN(CC3CC3)C2)CC1 ZINC000160700660 348019874 /nfs/dbraw/zinc/01/98/74/348019874.db2.gz FYCDSGMEWXESFY-ZBFHGGJFSA-N 0 3 293.455 2.692 20 70 CFIDHN CC[C@H]1CCCN(C(=O)N[C@H]2CCN(CC3CC3)C2)CC1 ZINC000160700802 348019956 /nfs/dbraw/zinc/01/99/56/348019956.db2.gz FYCDSGMEWXESFY-HOCLYGCPSA-N 0 3 293.455 2.692 20 70 CFIDHN C[C@@H]1CN(C(=O)N[C@H]2CCN(CC3CC3)C2)c2ccccc21 ZINC000160760234 348020394 /nfs/dbraw/zinc/02/03/94/348020394.db2.gz CFKWJASMCWHDKU-HIFRSBDPSA-N 0 3 299.418 2.804 20 70 CFIDHN Cc1cccc([C@@H]2CCCN2CCCc2cnn(C)c2)n1 ZINC000159819533 541012869 /nfs/dbraw/zinc/01/28/69/541012869.db2.gz MUQKIQGEBIGENZ-KRWDZBQOSA-N 0 3 284.407 2.893 20 70 CFIDHN CCn1nccc1CN[C@@H](C)Cc1ccccc1F ZINC000160108348 541021320 /nfs/dbraw/zinc/02/13/20/541021320.db2.gz YHNHLMHOHYACQC-LBPRGKRZSA-N 0 3 261.344 2.763 20 70 CFIDHN Oc1ccc(CN[C@H]2CCc3c2cccc3O)cc1 ZINC000161479654 541651454 /nfs/dbraw/zinc/65/14/54/541651454.db2.gz XVQUCBDKXZOJRM-HNNXBMFYSA-N 0 3 255.317 2.875 20 70 CFIDHN CSCC[C@H](N)C(=O)N1CCCC2(CCCCC2)C1 ZINC000159859379 378735788 /nfs/dbraw/zinc/73/57/88/378735788.db2.gz VKFVASJERNJAMB-ZDUSSCGKSA-N 0 3 284.469 2.640 20 70 CFIDHN CC[C@H](NC[C@@H](C)N1CCc2ccccc21)c1cnn(C)c1 ZINC000159903100 378737012 /nfs/dbraw/zinc/73/70/12/378737012.db2.gz RDDKSSAIUYDYJA-PBHICJAKSA-N 0 3 298.434 2.912 20 70 CFIDHN CN1CC[C@H]2[C@H](CCCN2c2nc(C(C)(C)C)ns2)C1 ZINC000160022847 378743832 /nfs/dbraw/zinc/74/38/32/378743832.db2.gz RBBFRPDLTRZEKN-NEPJUHHUSA-N 0 3 294.468 2.756 20 70 CFIDHN CCCN(CCc1cccc(F)c1)C(=O)[C@@H]1CCCCN1 ZINC000160095985 378748495 /nfs/dbraw/zinc/74/84/95/378748495.db2.gz RYNDVEQCHINTAF-INIZCTEOSA-N 0 3 292.398 2.749 20 70 CFIDHN CSC[C@H](CCO)N[C@H](CC(C)C)c1ccccn1 ZINC000160174488 378753505 /nfs/dbraw/zinc/75/35/05/378753505.db2.gz FNIWMZPUYDTAGX-DZGCQCFKSA-N 0 3 282.453 2.872 20 70 CFIDHN C[C@@]1(NCc2cc(Cl)c3c(c2)OCCCO3)CCOC1 ZINC000160181951 378753511 /nfs/dbraw/zinc/75/35/11/378753511.db2.gz KCBYTBVQUNEKDC-OAHLLOKOSA-N 0 3 297.782 2.770 20 70 CFIDHN Cc1cc(C)cc(CCN[C@@H](C)c2cnccn2)c1 ZINC000159475881 378711937 /nfs/dbraw/zinc/71/19/37/378711937.db2.gz ZJIYGJYTPVSTDE-AWEZNQCLSA-N 0 3 255.365 2.987 20 70 CFIDHN Fc1cc(F)cc(CNCCCOC[C@@H]2CCCO2)c1 ZINC000159643161 378721277 /nfs/dbraw/zinc/72/12/77/378721277.db2.gz CQOPSIORNICXCY-HNNXBMFYSA-N 0 3 285.334 2.640 20 70 CFIDHN COc1cccc([C@@H]2CCCN2CCn2ccnc2)c1 ZINC000159692190 378724290 /nfs/dbraw/zinc/72/42/90/378724290.db2.gz CXQBAAXWXSJNKR-INIZCTEOSA-N 0 3 271.364 2.729 20 70 CFIDHN COc1cccc([C@H]2CCCN2CCn2ccnc2)c1 ZINC000159692309 378724405 /nfs/dbraw/zinc/72/44/05/378724405.db2.gz CXQBAAXWXSJNKR-MRXNPFEDSA-N 0 3 271.364 2.729 20 70 CFIDHN C[C@@H]1C[C@@H](NCCO)c2cccc(Br)c21 ZINC000159707001 378726483 /nfs/dbraw/zinc/72/64/83/378726483.db2.gz QTXGXCJEDOVNNH-LDYMZIIASA-N 0 3 270.170 2.579 20 70 CFIDHN C[C@H](c1ccc(F)c(F)c1)N(C)CCn1ccnc1 ZINC000159709613 378726597 /nfs/dbraw/zinc/72/65/97/378726597.db2.gz LHWCJTQQNIGKNK-LLVKDONJSA-N 0 3 265.307 2.854 20 70 CFIDHN CC(C)(C)[C@H](N)C(=O)NCC(C)(C)c1cccc(F)c1 ZINC000159705348 378726628 /nfs/dbraw/zinc/72/66/28/378726628.db2.gz VEGMWPAMBVJMDW-CYBMUJFWSA-N 0 3 280.387 2.593 20 70 CFIDHN O=C(N[C@H]1CCC[C@@H]1c1ccccc1)[C@@H]1CCCCN1 ZINC000159712296 378726663 /nfs/dbraw/zinc/72/66/63/378726663.db2.gz NUCKGCZHXGUACW-PMPSAXMXSA-N 0 3 272.392 2.581 20 70 CFIDHN Cc1oc2ccccc2c1CN1CCC(CC(N)=O)CC1 ZINC000159781348 378730631 /nfs/dbraw/zinc/73/06/31/378730631.db2.gz XVGXPTKDFXMZJA-UHFFFAOYSA-N 0 3 286.375 2.829 20 70 CFIDHN CC[C@H](C(=O)NCc1ccccc1OCC(C)C)N(C)C ZINC000160295296 378762323 /nfs/dbraw/zinc/76/23/23/378762323.db2.gz UMVFNIZDIQIHPR-OAHLLOKOSA-N 0 3 292.423 2.678 20 70 CFIDHN CCc1nnc(CN[C@@H](C)C(C)(C)c2ccccc2)[nH]1 ZINC000160401981 378770423 /nfs/dbraw/zinc/77/04/23/378770423.db2.gz KLTLDBALTOFHHX-LBPRGKRZSA-N 0 3 272.396 2.823 20 70 CFIDHN CCc1nnc(C[NH2+][C@@H](C)C(C)(C)c2ccccc2)[n-]1 ZINC000160401981 378770428 /nfs/dbraw/zinc/77/04/28/378770428.db2.gz KLTLDBALTOFHHX-LBPRGKRZSA-N 0 3 272.396 2.823 20 70 CFIDHN CCCN(CCO)Cc1cc(OC)ccc1OC(F)F ZINC000161214535 378831700 /nfs/dbraw/zinc/83/17/00/378831700.db2.gz QXQSYXZQXOUIAO-UHFFFAOYSA-N 0 3 289.322 2.501 20 70 CFIDHN CSc1cc(C(=O)N2CCC[C@@H](N(C)C)C2)ccc1F ZINC000161235530 378832314 /nfs/dbraw/zinc/83/23/14/378832314.db2.gz NRHZDQPHINLISJ-GFCCVEGCSA-N 0 3 296.411 2.714 20 70 CFIDHN CC(C)[C@H](NC(=O)[C@H](C)N)c1ccccc1Cl ZINC000160829393 378802434 /nfs/dbraw/zinc/80/24/34/378802434.db2.gz VHLDHUPSFIXELI-CABZTGNLSA-N 0 3 254.761 2.501 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@@H](C)c1cccc(C)c1C ZINC000160836523 378802528 /nfs/dbraw/zinc/80/25/28/378802528.db2.gz KDGUEAASHOPHBJ-JSGCOSHPSA-N 0 3 280.437 2.561 20 70 CFIDHN CCC(CC)(C(=O)N1CCCNCC1)c1ccccc1 ZINC000160844546 378804558 /nfs/dbraw/zinc/80/45/58/378804558.db2.gz LEVVQGQEAKNKQI-UHFFFAOYSA-N 0 3 274.408 2.566 20 70 CFIDHN CCN(CC)C(=O)C[C@@H](C)NCc1ccc(C)s1 ZINC000160938077 378810966 /nfs/dbraw/zinc/81/09/66/378810966.db2.gz FUUOGSXDOTUTRU-LLVKDONJSA-N 0 3 268.426 2.793 20 70 CFIDHN C[C@@H](N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000160986223 378813087 /nfs/dbraw/zinc/81/30/87/378813087.db2.gz NBARJVOQTJUJBK-RQJHMYQMSA-N 0 3 261.152 2.518 20 70 CFIDHN CN(Cc1cnn(-c2ccccc2)c1)[C@H]1CCCC[C@@H]1O ZINC000161083794 378819744 /nfs/dbraw/zinc/81/97/44/378819744.db2.gz NMOUNGNSBHNARB-IRXDYDNUSA-N 0 3 285.391 2.608 20 70 CFIDHN CC[C@H](C)[C@@H](N)C(=O)NC[C@@H](C)Sc1ccccc1 ZINC000161119844 378822731 /nfs/dbraw/zinc/82/27/31/378822731.db2.gz ANVNWRITSIYBPL-OUCADQQQSA-N 0 3 280.437 2.657 20 70 CFIDHN CC[C@H](Cc1ccc(C)cc1)N(C)CC(OC)OC ZINC000161281365 378835855 /nfs/dbraw/zinc/83/58/55/378835855.db2.gz OXVWPBOJGLBHJO-OAHLLOKOSA-N 0 3 265.397 2.867 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@H](C)c1ccc(F)cc1Cl ZINC000161152259 378825913 /nfs/dbraw/zinc/82/59/13/378825913.db2.gz QCLUMPYVQIRWJI-PRHODGIISA-N 0 3 272.751 2.784 20 70 CFIDHN C[C@H](NC[C@@H](CO)c1ccccc1)c1cncs1 ZINC000161467521 378848945 /nfs/dbraw/zinc/84/89/45/378848945.db2.gz NWTHJCJIAKLFLN-AAEUAGOBSA-N 0 3 262.378 2.570 20 70 CFIDHN CCOCCN[C@H](c1ccc2c(c1)OCCO2)C(C)C ZINC000161471564 378849196 /nfs/dbraw/zinc/84/91/96/378849196.db2.gz SIVOKZJKFQTGTP-INIZCTEOSA-N 0 3 279.380 2.781 20 70 CFIDHN CS[C@H](C)CC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000161500859 378850888 /nfs/dbraw/zinc/85/08/88/378850888.db2.gz DAOWLBOTXGCKCV-CYBMUJFWSA-N 0 3 298.452 2.620 20 70 CFIDHN CSc1cc(C(=O)NC[C@H](C)N(C)C2CC2)ccc1F ZINC000161312266 378839218 /nfs/dbraw/zinc/83/92/18/378839218.db2.gz RIYDWHQXCFUKGL-JTQLQIEISA-N 0 3 296.411 2.760 20 70 CFIDHN CCCCN(C)CCNC(=O)NCC1(C2CC2)CCC1 ZINC000159836634 322328615 /nfs/dbraw/zinc/32/86/15/322328615.db2.gz BGUVJPKEZGSSID-UHFFFAOYSA-N 0 3 281.444 2.598 20 70 CFIDHN C[C@@H](N[C@H]1CCC[C@@H](C)C1)c1nnc2ccccn21 ZINC000217641725 382787269 /nfs/dbraw/zinc/78/72/69/382787269.db2.gz YBXCQDZYHAHGGO-UPJWGTAASA-N 0 3 258.369 2.959 20 70 CFIDHN CSC[C@@](C)(O)CNCc1ccc(C(F)(F)F)cc1 ZINC000217856178 382787941 /nfs/dbraw/zinc/78/79/41/382787941.db2.gz VEXBZUUDMIZLOO-LBPRGKRZSA-N 0 3 293.354 2.909 20 70 CFIDHN Cc1cc(CNCCNC(=O)OC(C)(C)C)ccc1F ZINC000218083390 382788725 /nfs/dbraw/zinc/78/87/25/382788725.db2.gz WQTMAOUHFYCRCP-UHFFFAOYSA-N 0 3 282.359 2.748 20 70 CFIDHN COC(=O)c1occc1CN[C@@H]1CCC[C@H](C)[C@@H]1C ZINC000217796059 393757813 /nfs/dbraw/zinc/75/78/13/393757813.db2.gz XIVDECVQWQOJJQ-GMXVVIOVSA-N 0 3 265.353 2.981 20 70 CFIDHN CCc1nsc(N2CCC[C@H]2CN2CCCCC2)n1 ZINC000160443716 394366373 /nfs/dbraw/zinc/36/63/73/394366373.db2.gz QTRLCDRLFZVJBK-LBPRGKRZSA-N 0 3 280.441 2.555 20 70 CFIDHN CC(C)(C)NC(=O)N1CCC[C@@H](NCc2ccccc2)C1 ZINC000161101147 394367134 /nfs/dbraw/zinc/36/71/34/394367134.db2.gz ATYACOUOFSOYNX-OAHLLOKOSA-N 0 3 289.423 2.749 20 70 CFIDHN CCO[C@@H]1C[C@@H](NC(=O)[C@@H](N)C(C)(C)C)C12CCCCC2 ZINC000161179373 286271046 /nfs/dbraw/zinc/27/10/46/286271046.db2.gz YXSFAJOTXUTJJU-MGPQQGTHSA-N 0 3 296.455 2.604 20 70 CFIDHN CC(C)N1CC[C@@H](N[C@@H]2CCCc3cc(F)ccc32)C1=O ZINC000159543506 275642444 /nfs/dbraw/zinc/64/24/44/275642444.db2.gz XUNMKYKPQAKHTN-HZPDHXFCSA-N 0 3 290.382 2.802 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](CC(C)C)c1ccccn1)CC2 ZINC000160323865 302681759 /nfs/dbraw/zinc/68/17/59/302681759.db2.gz YWJSOMDVLDJQSG-HOCLYGCPSA-N 0 3 299.422 2.673 20 70 CFIDHN CC(C)N1CC[C@@H](CNc2nnc(C(F)(F)F)s2)C1 ZINC000160167053 322333511 /nfs/dbraw/zinc/33/35/11/322333511.db2.gz FMHANQGLFOFLGJ-QMMMGPOBSA-N 0 3 294.346 2.699 20 70 CFIDHN CCOC1CC(Nc2cc(CN(C)C)ccc2OC)C1 ZINC000160200955 322334177 /nfs/dbraw/zinc/33/41/77/322334177.db2.gz GYMSVOZYXWHXLW-UHFFFAOYSA-N 0 3 278.396 2.736 20 70 CFIDHN CN1CCC(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1 ZINC000160244035 322334992 /nfs/dbraw/zinc/33/49/92/322334992.db2.gz FIUKUXANKKLNSR-RRFJBIMHSA-N 0 3 278.440 2.803 20 70 CFIDHN Cc1ccc(C(=O)NC[C@H]2CCCN2CC(C)C)s1 ZINC000160426311 322337913 /nfs/dbraw/zinc/33/79/13/322337913.db2.gz OFOUGBILPCAKSU-CYBMUJFWSA-N 0 3 280.437 2.907 20 70 CFIDHN CC(C)(N)C(=O)NCCc1cccc(-c2ccccc2)c1 ZINC000160509513 322339160 /nfs/dbraw/zinc/33/91/60/322339160.db2.gz HCQJKHPZGFJLJQ-UHFFFAOYSA-N 0 3 282.387 2.750 20 70 CFIDHN CCN1CCCC[C@H]1C(=O)NCCCSCC(C)C ZINC000160771351 322342844 /nfs/dbraw/zinc/34/28/44/322342844.db2.gz UFXYQHOYPONWQK-AWEZNQCLSA-N 0 3 286.485 2.756 20 70 CFIDHN CN(C)Cc1ccc(C(=O)NC[C@@H]2CC=CCC2)cc1 ZINC000161307870 322349782 /nfs/dbraw/zinc/34/97/82/322349782.db2.gz NIBZOQTXBJNTFV-CQSZACIVSA-N 0 3 272.392 2.834 20 70 CFIDHN CCCN1CCCN(C(=O)NCC(CC)CC)CC1 ZINC000160595441 519849351 /nfs/dbraw/zinc/84/93/51/519849351.db2.gz DKKGGQGOFQEOES-UHFFFAOYSA-N 0 3 269.433 2.550 20 70 CFIDHN CCCN1CCCN(C(=O)c2ccc(SC)cc2)CC1 ZINC000160387748 519851139 /nfs/dbraw/zinc/85/11/39/519851139.db2.gz BLDBANDWWLKFEH-UHFFFAOYSA-N 0 3 292.448 2.966 20 70 CFIDHN CCCCSCCC(=O)NCCN1CCCCCC1 ZINC000159652246 520951182 /nfs/dbraw/zinc/95/11/82/520951182.db2.gz BIKKTOMZHFUFOT-UHFFFAOYSA-N 0 3 286.485 2.902 20 70 CFIDHN CO[C@]1(C)C[C@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160899303 521762878 /nfs/dbraw/zinc/76/28/78/521762878.db2.gz GRVSLKZOXLOPRS-WMLDXEAASA-N 0 3 287.407 2.970 20 70 CFIDHN CC[C@H](O)CCNCc1cccc(OC(F)(F)F)c1 ZINC000217872273 522800437 /nfs/dbraw/zinc/80/04/37/522800437.db2.gz GZMGUDVATZLZBL-NSHDSACASA-N 0 3 277.286 2.836 20 70 CFIDHN CC[C@@H](N[C@H](CCO)CSC)c1cccc(OC)c1 ZINC000160199094 522942471 /nfs/dbraw/zinc/94/24/71/522942471.db2.gz VEDPWLQPZNKPEM-UKRRQHHQSA-N 0 3 283.437 2.850 20 70 CFIDHN Cc1ccc(C(=O)CCN(C[C@@H](C)O)C(C)C)cc1 ZINC000159548247 526041902 /nfs/dbraw/zinc/04/19/02/526041902.db2.gz HQPJXLZJSPBLFD-CQSZACIVSA-N 0 3 263.381 2.659 20 70 CFIDHN CCCNC(=O)c1cccc(CN[C@H](COC)C(C)C)c1 ZINC000160624923 528465109 /nfs/dbraw/zinc/46/51/09/528465109.db2.gz USGPXWSEZGFFAW-MRXNPFEDSA-N 0 3 292.423 2.587 20 70 CFIDHN CCCC[C@H](CC)CNC(=O)N1CCCN(CC)CC1 ZINC000159507366 528909865 /nfs/dbraw/zinc/90/98/65/528909865.db2.gz IWAOJGCUDSMZEM-HNNXBMFYSA-N 0 3 283.460 2.940 20 70 CFIDHN CN1CCC[C@H]1CNC(=O)CC/C=C/c1ccccc1 ZINC000160127100 530063173 /nfs/dbraw/zinc/06/31/73/530063173.db2.gz USRFJUAUBPBLPX-YKXBDCQTSA-N 0 3 272.392 2.690 20 70 CFIDHN CC(C)CCN(C(=O)N[C@@H]1CCN(CC2CC2)C1)C1CC1 ZINC000160634396 348018680 /nfs/dbraw/zinc/01/86/80/348018680.db2.gz TZRJQBNERIKQAW-OAHLLOKOSA-N 0 3 293.455 2.691 20 70 CFIDHN O=C(N[C@@H]1CCC[C@H]1c1ccccc1)[C@@H]1CCCCN1 ZINC000159712415 188438146 /nfs/dbraw/zinc/43/81/46/188438146.db2.gz NUCKGCZHXGUACW-XHSDSOJGSA-N 0 3 272.392 2.581 20 70 CFIDHN CCCn1nccc1CNC[C@@H](c1ccccc1)N(C)C ZINC000159972838 540666072 /nfs/dbraw/zinc/66/60/72/540666072.db2.gz ZGJGHFNJLYWCGI-KRWDZBQOSA-N 0 3 286.423 2.686 20 70 CFIDHN CCC(C)(CC)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21 ZINC000159495034 540996232 /nfs/dbraw/zinc/99/62/32/540996232.db2.gz XQJIEEXZKPVZFY-ZIAGYGMSSA-N 0 3 266.429 2.755 20 70 CFIDHN CCn1nccc1CN[C@H](C)Cc1ccccc1F ZINC000160108507 541021616 /nfs/dbraw/zinc/02/16/16/541021616.db2.gz YHNHLMHOHYACQC-GFCCVEGCSA-N 0 3 261.344 2.763 20 70 CFIDHN CC[C@@H](NC[C@@H](C)N1CCc2ccccc21)c1cnn(C)c1 ZINC000159903231 378737360 /nfs/dbraw/zinc/73/73/60/378737360.db2.gz RDDKSSAIUYDYJA-RHSMWYFYSA-N 0 3 298.434 2.912 20 70 CFIDHN CC[C@H](C)C[C@H](C)NC(=O)N1CCCN(CC)CC1 ZINC000159920337 378739196 /nfs/dbraw/zinc/73/91/96/378739196.db2.gz YATOMHLFGCRKBE-KBPBESRZSA-N 0 3 269.433 2.548 20 70 CFIDHN CN(CCc1cccc(OC(F)(F)F)c1)[C@@H]1CCOC1 ZINC000160068161 378746817 /nfs/dbraw/zinc/74/68/17/378746817.db2.gz OFMFOKIBAWQRQS-GFCCVEGCSA-N 0 3 289.297 2.848 20 70 CFIDHN Cc1cc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)ncn1 ZINC000160213289 378755540 /nfs/dbraw/zinc/75/55/40/378755540.db2.gz SOHWQGSYFWODSL-BBRMVZONSA-N 0 3 282.391 2.717 20 70 CFIDHN Cc1c(CNCCc2cccc(Cl)c2)cnn1C ZINC000159605412 378720149 /nfs/dbraw/zinc/72/01/49/378720149.db2.gz YBSVHBDSTXKPIZ-UHFFFAOYSA-N 0 3 263.772 2.714 20 70 CFIDHN CC[C@H]1CCCC[C@@H]1NC(=O)N1CCCN(CC)CC1 ZINC000159683884 378724348 /nfs/dbraw/zinc/72/43/48/378724348.db2.gz AZYBOBZZGIEEOF-GJZGRUSLSA-N 0 3 281.444 2.692 20 70 CFIDHN O=C(N[C@@H]1CCC[C@@H]1c1ccccc1)[C@@H]1CCCCN1 ZINC000159712551 378726719 /nfs/dbraw/zinc/72/67/19/378726719.db2.gz NUCKGCZHXGUACW-OAGGEKHMSA-N 0 3 272.392 2.581 20 70 CFIDHN CCC(=O)N1CC[C@H](N[C@H](C)c2ccccc2C)C1 ZINC000159819872 378731928 /nfs/dbraw/zinc/73/19/28/378731928.db2.gz QWZKGNDDNZEPHV-KGLIPLIRSA-N 0 3 260.381 2.657 20 70 CFIDHN Cc1ccc([C@@H]2CSCCN2CCn2ccnc2)cc1 ZINC000159832129 378733814 /nfs/dbraw/zinc/73/38/14/378733814.db2.gz AGJBAPVJCXJNGM-INIZCTEOSA-N 0 3 287.432 2.982 20 70 CFIDHN CC(C)(C)OC(=O)c1ccc(CN2CCC[C@H]2CO)cc1 ZINC000159852124 378734183 /nfs/dbraw/zinc/73/41/83/378734183.db2.gz WHKKDUPBOXWMLL-HNNXBMFYSA-N 0 3 291.391 2.599 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(Cl)s1)CC2 ZINC000160370614 378767330 /nfs/dbraw/zinc/76/73/30/378767330.db2.gz OVDMBGOAHFAPIK-SCZZXKLOSA-N 0 3 296.827 2.967 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(C)c(C)c1)CC2 ZINC000160414218 378770751 /nfs/dbraw/zinc/77/07/51/378770751.db2.gz XURVSWYOEZYOHA-XJKSGUPXSA-N 0 3 284.407 2.869 20 70 CFIDHN CC[C@H](COC)NCc1ccc(N2CCCCCC2)nc1 ZINC000160553160 378781381 /nfs/dbraw/zinc/78/13/81/378781381.db2.gz WQFUTHYAKOWEBG-MRXNPFEDSA-N 0 3 291.439 2.977 20 70 CFIDHN Cc1noc(C)c1[C@H](C)CC(=O)N(CCN(C)C)C(C)C ZINC000161182978 378829271 /nfs/dbraw/zinc/82/92/71/378829271.db2.gz GRYKUPKWOBMYOD-GFCCVEGCSA-N 0 3 295.427 2.584 20 70 CFIDHN CSc1cc(C(=O)N2CCC[C@H](N(C)C)C2)ccc1F ZINC000161235651 378832135 /nfs/dbraw/zinc/83/21/35/378832135.db2.gz NRHZDQPHINLISJ-LBPRGKRZSA-N 0 3 296.411 2.714 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@H](C)c1cccc(C)c1C ZINC000160836389 378802791 /nfs/dbraw/zinc/80/27/91/378802791.db2.gz KDGUEAASHOPHBJ-OCCSQVGLSA-N 0 3 280.437 2.561 20 70 CFIDHN CCC[C@@H](NCC(=O)NC(C)C)c1ccc(OC)cc1 ZINC000160917583 378809337 /nfs/dbraw/zinc/80/93/37/378809337.db2.gz PKFGQIYVTSZTBC-OAHLLOKOSA-N 0 3 278.396 2.651 20 70 CFIDHN Cc1nccn1CCCN1CCN(C)C[C@@H]1c1ccccc1 ZINC000161329737 378839815 /nfs/dbraw/zinc/83/98/15/378839815.db2.gz MJLNYHRYGPVXKB-GOSISDBHSA-N 0 3 298.434 2.570 20 70 CFIDHN C[C@H]1CN(C[C@@H](O)c2cc3ccccc3o2)CCCO1 ZINC000217603558 382787309 /nfs/dbraw/zinc/78/73/09/382787309.db2.gz MYRORXNAGJOYDJ-GXTWGEPZSA-N 0 3 275.348 2.577 20 70 CFIDHN CCCn1c2ccccc2nc1CNC[C@@H]1CCCN1C ZINC000218235296 382789864 /nfs/dbraw/zinc/78/98/64/382789864.db2.gz PWSPERSCDBWUKM-AWEZNQCLSA-N 0 3 286.423 2.630 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H](C)CCC(C)(C)C)CC1 ZINC000159883503 285210721 /nfs/dbraw/zinc/21/07/21/285210721.db2.gz REANZWQRRAAEQT-AWEZNQCLSA-N 0 3 283.460 2.938 20 70 CFIDHN CC1(C)CC[C@@H](NCCNC(=O)C2CC2)c2ccccc21 ZINC000160694805 394366937 /nfs/dbraw/zinc/36/69/37/394366937.db2.gz UCCOAGGOXVNMJG-MRXNPFEDSA-N 0 3 286.419 2.915 20 70 CFIDHN COc1ccc2c(c1)C[C@@H](NCc1ccoc1)CC2 ZINC000159553597 274125645 /nfs/dbraw/zinc/12/56/45/274125645.db2.gz IDUBTNLLGUGBAI-HNNXBMFYSA-N 0 3 257.333 2.935 20 70 CFIDHN Cc1ccc2nccc(N3CCC(n4ccnn4)CC3)c2c1 ZINC000160205500 274786922 /nfs/dbraw/zinc/78/69/22/274786922.db2.gz HGCOPVRWMUSTIZ-UHFFFAOYSA-N 0 3 293.374 2.976 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H]2CCCCC2(C)C)CC1 ZINC000159976358 279285929 /nfs/dbraw/zinc/28/59/29/279285929.db2.gz DMQHMHFEEFLPBS-CQSZACIVSA-N 0 3 281.444 2.692 20 70 CFIDHN CC(C)C[C@@H](C)NC(=O)N[C@H](C)CN1CCCCC1 ZINC000159611327 322325025 /nfs/dbraw/zinc/32/50/25/322325025.db2.gz PFVPNUFTEFNBRW-ZIAGYGMSSA-N 0 3 269.433 2.595 20 70 CFIDHN Cc1csc([C@@H](NCCC(C)(C)O)C2CC2)n1 ZINC000159614491 322325042 /nfs/dbraw/zinc/32/50/42/322325042.db2.gz AXJMRGMVPRREKI-NSHDSACASA-N 0 3 254.399 2.653 20 70 CFIDHN CC(C)C[C@@H](C)NC(=O)N[C@@H](C)CN1CCCCC1 ZINC000159611058 322325312 /nfs/dbraw/zinc/32/53/12/322325312.db2.gz PFVPNUFTEFNBRW-KGLIPLIRSA-N 0 3 269.433 2.595 20 70 CFIDHN CCCN(CCO)Cc1cnc(-c2ccc(C)o2)s1 ZINC000161231822 322349262 /nfs/dbraw/zinc/34/92/62/322349262.db2.gz MKCOMFSJVXCEJY-UHFFFAOYSA-N 0 3 280.393 2.916 20 70 CFIDHN CCCCCOc1ccc([C@@H](C)NCCO)cc1 ZINC000159712453 520256998 /nfs/dbraw/zinc/25/69/98/520256998.db2.gz OOXJVJQWQKESFG-CYBMUJFWSA-N 0 3 251.370 2.899 20 70 CFIDHN CC1(C)Cc2cccc(CNCCOCC3CC3)c2O1 ZINC000217803133 520582616 /nfs/dbraw/zinc/58/26/16/520582616.db2.gz MGFLTXDWULZPKY-UHFFFAOYSA-N 0 3 275.392 2.916 20 70 CFIDHN CC1CCN(CCNC(=O)[C@@H]2CCC[C@H](C)C2)CC1 ZINC000160552690 521012916 /nfs/dbraw/zinc/01/29/16/521012916.db2.gz ODIYJYDJYYXVGV-LSDHHAIUSA-N 0 3 266.429 2.661 20 70 CFIDHN CCC(CC)N(CCOC)Cc1cnc2ccccn12 ZINC000159706856 521560807 /nfs/dbraw/zinc/56/08/07/521560807.db2.gz HMYPIEILUGYUKO-UHFFFAOYSA-N 0 3 275.396 2.971 20 70 CFIDHN COC(=O)c1ccc(CN2CC[C@H](C(C)(C)C)C2)nc1 ZINC000160583722 522012001 /nfs/dbraw/zinc/01/20/01/522012001.db2.gz VFWSQLHFSXQFTJ-ZDUSSCGKSA-N 0 3 276.380 2.736 20 70 CFIDHN CC[C@H](C)c1cc(C(=O)N[C@@H](C)CN2CCCCC2)on1 ZINC000160369569 522031647 /nfs/dbraw/zinc/03/16/47/522031647.db2.gz GHLZMJUQDYYTEH-STQMWFEESA-N 0 3 293.411 2.792 20 70 CFIDHN CC[C@H](N[C@@H](CCO)CSC)c1cccc(OC)c1 ZINC000160198684 522706485 /nfs/dbraw/zinc/70/64/85/522706485.db2.gz VEDPWLQPZNKPEM-ZFWWWQNUSA-N 0 3 283.437 2.850 20 70 CFIDHN COc1ccc(CNC[C@H]2CCC(C)(C)O2)cc1OC ZINC000160215506 524072037 /nfs/dbraw/zinc/07/20/37/524072037.db2.gz QXJVTVBKHLXJLR-CYBMUJFWSA-N 0 3 279.380 2.751 20 70 CFIDHN C[C@H]1CCC[C@@H](C(=O)NCCN2CCCCCC2)C1 ZINC000160222274 524126935 /nfs/dbraw/zinc/12/69/35/524126935.db2.gz XOLCUAVEMPATRO-LSDHHAIUSA-N 0 3 266.429 2.805 20 70 CFIDHN COc1ccc([C@H](C)N[C@H](CCO)CSC)cc1F ZINC000160218637 525335731 /nfs/dbraw/zinc/33/57/31/525335731.db2.gz LWYJXAHKJKWYOI-CMPLNLGQSA-N 0 3 287.400 2.599 20 70 CFIDHN CSCCCCC(=O)NCCN1CCCCCC1 ZINC000159654768 525402241 /nfs/dbraw/zinc/40/22/41/525402241.db2.gz ZGSHWHRAHAIEOV-UHFFFAOYSA-N 0 3 272.458 2.512 20 70 CFIDHN Cc1ccc(C(=O)CCN2C[C@@H](C)N(C)[C@H](C)C2)cc1 ZINC000160216538 526045219 /nfs/dbraw/zinc/04/52/19/526045219.db2.gz JFWKVZKUPNJWLK-HUUCEWRRSA-N 0 3 274.408 2.592 20 70 CFIDHN Cc1nc(-c2cc([C@H](C)NCCO)cs2)cs1 ZINC000159695869 526563563 /nfs/dbraw/zinc/56/35/63/526563563.db2.gz LHSNWLQHTBAJLQ-QMMMGPOBSA-N 0 3 268.407 2.823 20 70 CFIDHN Cc1nc2ccccn2c1CN1CCSC(C)(C)C1 ZINC000161309834 527178637 /nfs/dbraw/zinc/17/86/37/527178637.db2.gz RVBWAAHPYUDWER-UHFFFAOYSA-N 0 3 275.421 2.970 20 70 CFIDHN Cc1nn(C)c(C)c1CN(C)CCc1cccs1 ZINC000161058087 527627399 /nfs/dbraw/zinc/62/73/99/527627399.db2.gz WAMJHBWUISKNSL-UHFFFAOYSA-N 0 3 263.410 2.773 20 70 CFIDHN CCCNC(=O)c1cccc(CN[C@@H](COC)C(C)C)c1 ZINC000160624828 528463828 /nfs/dbraw/zinc/46/38/28/528463828.db2.gz USGPXWSEZGFFAW-INIZCTEOSA-N 0 3 292.423 2.587 20 70 CFIDHN CCCC[C@@H](CC)CNC(=O)N1CCCN(CC)CC1 ZINC000159507236 528778405 /nfs/dbraw/zinc/77/84/05/528778405.db2.gz IWAOJGCUDSMZEM-OAHLLOKOSA-N 0 3 283.460 2.940 20 70 CFIDHN CCN1CCCN(C(=O)NC[C@@H]2CCC[C@H](C)C2)CC1 ZINC000159741964 529026856 /nfs/dbraw/zinc/02/68/56/529026856.db2.gz OUVMKQHFGNWROG-LSDHHAIUSA-N 0 3 281.444 2.550 20 70 CFIDHN CC[C@H]1CCC[C@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159596908 529233783 /nfs/dbraw/zinc/23/37/83/529233783.db2.gz QJDQYFWSHDUCDD-UONOGXRCSA-N 0 3 269.433 2.547 20 70 CFIDHN CCCCN(C)C(=O)C1CCN(CCSCC)CC1 ZINC000159410133 348012558 /nfs/dbraw/zinc/01/25/58/348012558.db2.gz BNCQCCNOKBIOOZ-UHFFFAOYSA-N 0 3 286.485 2.710 20 70 CFIDHN CCc1ccc([C@@H](C)CC(=O)NCCN(C)CC)cc1 ZINC000160148608 348015987 /nfs/dbraw/zinc/01/59/87/348015987.db2.gz ZGTJYWWAJDKHIM-AWEZNQCLSA-N 0 3 276.424 2.811 20 70 CFIDHN FC(F)(F)c1nnc(N[C@H]2CCN3CCCC[C@@H]23)s1 ZINC000160326911 348017252 /nfs/dbraw/zinc/01/72/52/348017252.db2.gz WDKZMHPDOKXGJP-YUMQZZPRSA-N 0 3 292.330 2.596 20 70 CFIDHN Cc1cc(NC(=O)C(C)(C)N)ccc1OCC(F)(F)F ZINC000161117826 188509433 /nfs/dbraw/zinc/50/94/33/188509433.db2.gz NAFADSIFANOALI-UHFFFAOYSA-N 0 3 290.285 2.612 20 70 CFIDHN C[C@@H](N)C(=O)N[C@H](CC1CCCCC1)C(C)(C)C ZINC000160073626 296014782 /nfs/dbraw/zinc/01/47/82/296014782.db2.gz BFMGYLUCCGFUCA-DGCLKSJQSA-N 0 3 254.418 2.835 20 70 CFIDHN C[C@@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159386744 540991937 /nfs/dbraw/zinc/99/19/37/540991937.db2.gz IJHOBHKXTZMPJI-HIFRSBDPSA-N 0 3 287.407 2.523 20 70 CFIDHN COc1ccc(CN(CCc2nccs2)C(C)C)cn1 ZINC000159794360 541012151 /nfs/dbraw/zinc/01/21/51/541012151.db2.gz DYZPCPNTVVPSKG-UHFFFAOYSA-N 0 3 291.420 3.000 20 70 CFIDHN CCCC(=O)Nc1cccc(CN[C@H](COC)C2CC2)c1 ZINC000159944241 541018891 /nfs/dbraw/zinc/01/88/91/541018891.db2.gz PMNASOWUKKKWDO-MRXNPFEDSA-N 0 3 290.407 2.940 20 70 CFIDHN CS(=O)(=O)CCCCN1CCC[C@H]1Cc1ccccc1 ZINC000161328484 541586400 /nfs/dbraw/zinc/58/64/00/541586400.db2.gz OHLMOPFLTSHXIW-INIZCTEOSA-N 0 3 295.448 2.518 20 70 CFIDHN Cc1ccc(CN[C@@H](C)c2ccc(-n3cncn3)cc2)cn1 ZINC000161322479 541585517 /nfs/dbraw/zinc/58/55/17/541585517.db2.gz IBXBOMDEMPDMIS-AWEZNQCLSA-N 0 3 293.374 2.822 20 70 CFIDHN C[C@H](NC[C@](C)(O)c1ccsc1)c1cncs1 ZINC000159959267 378740202 /nfs/dbraw/zinc/74/02/02/378740202.db2.gz GJSJPTUFXCHILP-CABZTGNLSA-N 0 3 268.407 2.763 20 70 CFIDHN Clc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cn1 ZINC000159649413 378722580 /nfs/dbraw/zinc/72/25/80/378722580.db2.gz XNIGWSPBNSIARK-BNOWGMLFSA-N 0 3 278.783 2.782 20 70 CFIDHN Cc1c2ccccc2oc1[C@@H](NC(=O)[C@H](C)N)C(C)C ZINC000159695916 378724389 /nfs/dbraw/zinc/72/43/89/378724389.db2.gz HEVHRLACGVYTRY-FZMZJTMJSA-N 0 3 274.364 2.902 20 70 CFIDHN CN(Cc1cccc(OC(F)F)c1)C[C@@H]1CCC[C@@H]1O ZINC000159715211 378726310 /nfs/dbraw/zinc/72/63/10/378726310.db2.gz MNCLHRDRWPNHBC-JSGCOSHPSA-N 0 3 285.334 2.881 20 70 CFIDHN NC(=O)[C@H](NCCC1Cc2ccccc2C1)c1ccccc1 ZINC000159734696 378727245 /nfs/dbraw/zinc/72/72/45/378727245.db2.gz XLOQIEADZFQMPW-GOSISDBHSA-N 0 3 294.398 2.608 20 70 CFIDHN CC(C)[C@@H](N)C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000159812845 378732305 /nfs/dbraw/zinc/73/23/05/378732305.db2.gz NOQQKEZABVNVPM-GXTWGEPZSA-N 0 3 280.799 2.639 20 70 CFIDHN CCc1nc(CN[C@H](c2ccc(OC)cc2)C(C)C)n[nH]1 ZINC000160282016 378760864 /nfs/dbraw/zinc/76/08/64/378760864.db2.gz YDJGCDOLNVESFH-INIZCTEOSA-N 0 3 288.395 2.863 20 70 CFIDHN CCc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1 ZINC000160332143 378763918 /nfs/dbraw/zinc/76/39/18/378763918.db2.gz ZIPOWMFLYRODMU-MLGOLLRUSA-N 0 3 284.407 2.815 20 70 CFIDHN CC[C@H](NCC(=O)NCC(F)(F)F)c1ccc(F)cc1 ZINC000160786829 378799050 /nfs/dbraw/zinc/79/90/50/378799050.db2.gz RXQDHBRNRVUCBN-NSHDSACASA-N 0 3 292.276 2.545 20 70 CFIDHN CC(C)C1(CNC(=O)[C@H](C)[C@@H](N)c2ccccc2)CC1 ZINC000160818994 378801836 /nfs/dbraw/zinc/80/18/36/378801836.db2.gz DYXCPGKMKJBJPT-UKRRQHHQSA-N 0 3 274.408 2.875 20 70 CFIDHN CC(C)[C@H](NC(=O)[C@@H](C)N)c1ccccc1Cl ZINC000160829509 378802819 /nfs/dbraw/zinc/80/28/19/378802819.db2.gz VHLDHUPSFIXELI-SKDRFNHKSA-N 0 3 254.761 2.501 20 70 CFIDHN C[C@@H]1C[C@@H](Nc2cnccn2)CN1Cc1ccccc1 ZINC000160930711 378809540 /nfs/dbraw/zinc/80/95/40/378809540.db2.gz MSQYLGMPNVDXRE-UKRRQHHQSA-N 0 3 268.364 2.552 20 70 CFIDHN CC[C@@H](N[C@H]1CCN(C(C)C)C1=O)c1ccc(F)cc1 ZINC000160928788 378810186 /nfs/dbraw/zinc/81/01/86/378810186.db2.gz YPAJHDWTYKZUIT-CABCVRRESA-N 0 3 278.371 2.876 20 70 CFIDHN CCN(C(=O)CN)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000161115471 378822990 /nfs/dbraw/zinc/82/29/90/378822990.db2.gz ZTOZXZQGOZDUDJ-VIFPVBQESA-N 0 3 274.286 2.574 20 70 CFIDHN C[C@H](NCCCc1nnc2n1CCCCC2)c1ccco1 ZINC000161169675 378827685 /nfs/dbraw/zinc/82/76/85/378827685.db2.gz ZIFMPBDJPRIIRZ-ZDUSSCGKSA-N 0 3 288.395 2.881 20 70 CFIDHN CCCN(CCN(C)C)C(=O)c1cc(CC)c(CC)o1 ZINC000159394220 322322139 /nfs/dbraw/zinc/32/21/39/322322139.db2.gz FQFXWKKVKVMBNP-UHFFFAOYSA-N 0 3 280.412 2.818 20 70 CFIDHN CSC[C@@](C)(O)CNCc1ccc2c(c1)CC(C)(C)O2 ZINC000217840999 382787854 /nfs/dbraw/zinc/78/78/54/382787854.db2.gz ZTIUEHPPZFVNOP-INIZCTEOSA-N 0 3 295.448 2.604 20 70 CFIDHN CSC[C@](C)(O)CNCc1ccccc1OC(C)C ZINC000217847362 382787998 /nfs/dbraw/zinc/78/79/98/382787998.db2.gz HSIZSDCIUOROHI-OAHLLOKOSA-N 0 3 283.437 2.677 20 70 CFIDHN Cc1ccc(CNCCNC(=O)OC(C)(C)C)cc1F ZINC000218082906 382788864 /nfs/dbraw/zinc/78/88/64/382788864.db2.gz KAAAXUROHCJIMY-UHFFFAOYSA-N 0 3 282.359 2.748 20 70 CFIDHN CC[C@H](C(=O)N[C@H]1CCSc2c(F)cccc21)N(C)C ZINC000160097662 394366050 /nfs/dbraw/zinc/36/60/50/394366050.db2.gz ABBFACKOQWJTPW-QWHCGFSZSA-N 0 3 296.411 2.819 20 70 CFIDHN CC[C@H](C)[C@@H](N)C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000160344965 394366362 /nfs/dbraw/zinc/36/63/62/394366362.db2.gz QTJYJCOCLKCQCT-NJZAAPMLSA-N 0 3 290.407 2.778 20 70 CFIDHN CC[C@@H](COC)N[C@@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000159612178 286851092 /nfs/dbraw/zinc/85/10/92/286851092.db2.gz HRABSWQEOAQVOY-JSGCOSHPSA-N 0 3 299.436 2.556 20 70 CFIDHN C[C@@H](N)C(=O)NCC1(Sc2ccccc2)CCCC1 ZINC000159674235 286906555 /nfs/dbraw/zinc/90/65/55/286906555.db2.gz LREXMWCVLWZTFG-GFCCVEGCSA-N 0 3 278.421 2.555 20 70 CFIDHN Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)[C@H](C)N)cc1 ZINC000161234082 280971103 /nfs/dbraw/zinc/97/11/03/280971103.db2.gz AURGJYPCEQUJAM-YDHLFZDLSA-N 0 3 260.381 2.642 20 70 CFIDHN Cc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)s1 ZINC000160303375 280981418 /nfs/dbraw/zinc/98/14/18/280981418.db2.gz TWNOGJYLIZFOQH-JQWIXIFHSA-N 0 3 276.409 2.622 20 70 CFIDHN COCCCN1CCN([C@@H](C)c2cccc(F)c2)CC1 ZINC000159464800 322322726 /nfs/dbraw/zinc/32/27/26/322322726.db2.gz NXHUJOHCUNHCDG-AWEZNQCLSA-N 0 3 280.387 2.541 20 70 CFIDHN COCCCN1CCN([C@H](C)c2cccc(F)c2)CC1 ZINC000159464957 322323034 /nfs/dbraw/zinc/32/30/34/322323034.db2.gz NXHUJOHCUNHCDG-CQSZACIVSA-N 0 3 280.387 2.541 20 70 CFIDHN CN1CCC(Oc2ccc(NCc3ccncc3)cn2)CC1 ZINC000160154433 322333542 /nfs/dbraw/zinc/33/35/42/322333542.db2.gz PMAPOVQTDFMUKO-UHFFFAOYSA-N 0 3 298.390 2.562 20 70 CFIDHN C[C@@H](N[C@@H]1CCN(CC(F)(F)F)C1)c1ccco1 ZINC000160223368 322334824 /nfs/dbraw/zinc/33/48/24/322334824.db2.gz XKPGSONTIPYUOF-NXEZZACHSA-N 0 3 262.275 2.567 20 70 CFIDHN Cc1cccc([C@@H]2CCCN2CCOC[C@@H]2CCCO2)n1 ZINC000160240026 322335375 /nfs/dbraw/zinc/33/53/75/322335375.db2.gz ULPWJKREONYUKF-RDJZCZTQSA-N 0 3 290.407 2.723 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@H]1CCCC[C@H]1C ZINC000160756184 322342502 /nfs/dbraw/zinc/34/25/02/322342502.db2.gz WCHGHBCJHXZRRT-KGLIPLIRSA-N 0 3 275.458 2.710 20 70 CFIDHN CCN(C)C(=O)CNC1CC(c2ccccc2Cl)C1 ZINC000217383007 520173727 /nfs/dbraw/zinc/17/37/27/520173727.db2.gz FKSSXDHMEPJABD-UHFFFAOYSA-N 0 3 280.799 2.654 20 70 CFIDHN CCO[C@@H]1C[C@@H](N(C)Cc2cnc3ccccn23)C1(C)C ZINC000160570030 520344434 /nfs/dbraw/zinc/34/44/34/520344434.db2.gz AGFVRXUSVUMGFY-HUUCEWRRSA-N 0 3 287.407 2.970 20 70 CFIDHN CCC[C@H](C)CC(=O)N1CCCN(CCC)CC1 ZINC000160370693 521010142 /nfs/dbraw/zinc/01/01/42/521010142.db2.gz LKWVBPMUKIEZEJ-AWEZNQCLSA-N 0 3 254.418 2.757 20 70 CFIDHN CCOCCCN(CC(=O)Nc1ccc(F)cc1)C(C)C ZINC000160575716 521704818 /nfs/dbraw/zinc/70/48/18/521704818.db2.gz PHLJXCFDCQWYDI-UHFFFAOYSA-N 0 3 296.386 2.901 20 70 CFIDHN CCOCCCN1CCN(CC2CCCCC2)CC1 ZINC000159702434 521707036 /nfs/dbraw/zinc/70/70/36/521707036.db2.gz UCMCLFKJHHWKBN-UHFFFAOYSA-N 0 3 268.445 2.611 20 70 CFIDHN COc1cc([C@H](C)N[C@@H](C)[C@@H](CO)SC)ccc1F ZINC000218255740 522945103 /nfs/dbraw/zinc/94/51/03/522945103.db2.gz LQVLGZYOUZKQLL-PKFCDNJMSA-N 0 3 287.400 2.597 20 70 CFIDHN CCn1cc([C@H](C)NC[C@@](C)(O)CCC(C)C)cn1 ZINC000159392421 523471565 /nfs/dbraw/zinc/47/15/65/523471565.db2.gz ZLHJWMYZNFIFFC-ZFWWWQNUSA-N 0 3 267.417 2.741 20 70 CFIDHN CN1CCC[C@@H]2CN(c3nc(C(C)(C)C)ns3)CC[C@@H]21 ZINC000159998707 523832787 /nfs/dbraw/zinc/83/27/87/523832787.db2.gz BHDMMAAFNSVCRH-NEPJUHHUSA-N 0 3 294.468 2.756 20 70 CFIDHN Cc1ccc(C)c([C@@H](C)NCCNC(=O)c2ccco2)c1 ZINC000160712214 524203450 /nfs/dbraw/zinc/20/34/50/524203450.db2.gz SYVZSYZYCGUMBI-CQSZACIVSA-N 0 3 286.375 2.977 20 70 CFIDHN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1cnc(C(C)(C)C)s1 ZINC000159646029 524341641 /nfs/dbraw/zinc/34/16/41/524341641.db2.gz ILNOCXCICGYIEH-WDEREUQCSA-N 0 3 295.452 2.526 20 70 CFIDHN COc1ccc([C@H](C)N(C)CCn2ccnc2)cc1 ZINC000161354836 525299181 /nfs/dbraw/zinc/29/91/81/525299181.db2.gz STCWIBWXQHEQAQ-ZDUSSCGKSA-N 0 3 259.353 2.585 20 70 CFIDHN CSC[C@H](CCO)N[C@H](C)c1ccc(F)cc1 ZINC000160355788 525698708 /nfs/dbraw/zinc/69/87/08/525698708.db2.gz ZWYXWWXPYOJYKD-MFKMUULPSA-N 0 3 257.374 2.590 20 70 CFIDHN CSC[C@H](CCO)N[C@H]1CCc2cc(F)ccc21 ZINC000160153991 525701657 /nfs/dbraw/zinc/70/16/57/525701657.db2.gz NUJQIVGMGSUYQN-JSGCOSHPSA-N 0 3 269.385 2.517 20 70 CFIDHN Cc1nc(-c2cc([C@@H](C)NCCO)cs2)cs1 ZINC000159695735 526562410 /nfs/dbraw/zinc/56/24/10/526562410.db2.gz LHSNWLQHTBAJLQ-MRVPVSSYSA-N 0 3 268.407 2.823 20 70 CFIDHN CCCC(O)(CCC)CC(=O)N(C)CC1CCN(C)CC1 ZINC000161407630 528002968 /nfs/dbraw/zinc/00/29/68/528002968.db2.gz QGCBDBFQNBAIIW-UHFFFAOYSA-N 0 3 298.471 2.508 20 70 CFIDHN CC(C)[C@@H](CC1CCCC1)C(=O)N1CCCNCC1 ZINC000160843583 528429707 /nfs/dbraw/zinc/42/97/07/528429707.db2.gz ACTNBTMPOJEZTJ-OAHLLOKOSA-N 0 3 266.429 2.661 20 70 CFIDHN CC[C@H]1CCC[C@@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159596649 529227863 /nfs/dbraw/zinc/22/78/63/529227863.db2.gz QJDQYFWSHDUCDD-KBPBESRZSA-N 0 3 269.433 2.547 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cc(F)cc(F)c1)CC2 ZINC000160456500 282117401 /nfs/dbraw/zinc/11/74/01/282117401.db2.gz CIIWJYHUSVXHPK-XPTSAGLGSA-N 0 3 292.333 2.530 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H]1CCCc3sccc31)CC2 ZINC000160493354 282127929 /nfs/dbraw/zinc/12/79/29/282127929.db2.gz PUEWRNHZNFWYFO-YPMHNXCESA-N 0 3 288.420 2.630 20 70 CFIDHN CC[C@@H](C)[C@H](N)C(=O)NC[C@@H](C)Oc1ccc(Cl)cc1 ZINC000161137662 529417177 /nfs/dbraw/zinc/41/71/77/529417177.db2.gz HQFOUCDKZNGQQU-GYSYKLTISA-N 0 3 298.814 2.597 20 70 CFIDHN CN(CCOCC1CC1)CCOc1cccc(F)c1 ZINC000159390598 529922326 /nfs/dbraw/zinc/92/23/26/529922326.db2.gz INEBLENVCFQWLC-UHFFFAOYSA-N 0 3 267.344 2.563 20 70 CFIDHN CCN(C(=O)N[C@H]1CCN(CC2CC2)C1)[C@H](C)C(C)C ZINC000160758507 348020439 /nfs/dbraw/zinc/02/04/39/348020439.db2.gz MPMATAHIOSAYOW-HIFRSBDPSA-N 0 3 281.444 2.547 20 70 CFIDHN CC(C)(C)n1cc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cn1 ZINC000159465878 539825825 /nfs/dbraw/zinc/82/58/25/539825825.db2.gz FKGMFHRLDGKMHN-KFWWJZLASA-N 0 3 289.423 2.685 20 70 CFIDHN Cc1c(CN[C@@H](C)Cc2ccccc2F)cnn1C ZINC000160755638 188489623 /nfs/dbraw/zinc/48/96/23/188489623.db2.gz ODJIXDITUNSDSV-NSHDSACASA-N 0 3 261.344 2.588 20 70 CFIDHN Cc1nccc(NC(=O)N(CCN(C)C)C(C)C)c1Cl ZINC000159949432 541018809 /nfs/dbraw/zinc/01/88/09/541018809.db2.gz IIHXZSHJJPLZMI-UHFFFAOYSA-N 0 3 298.818 2.847 20 70 CFIDHN C[C@H](CN[C@H](C)c1cnn(C)c1)N1CCc2ccccc21 ZINC000159921131 378739355 /nfs/dbraw/zinc/73/93/55/378739355.db2.gz OZFNHOQQWRUWDT-ZIAGYGMSSA-N 0 3 284.407 2.522 20 70 CFIDHN CCn1cc([C@@H](C)NC[C@@](C)(O)c2ccsc2)cn1 ZINC000160024914 378743630 /nfs/dbraw/zinc/74/36/30/378743630.db2.gz ZYDONWLHXUXNNI-BXUZGUMPSA-N 0 3 279.409 2.523 20 70 CFIDHN CCCC[C@@H](COC)NCc1cccc(C(=O)NCC)c1 ZINC000160186248 378753773 /nfs/dbraw/zinc/75/37/73/378753773.db2.gz HJTAFKWXPVKFTG-INIZCTEOSA-N 0 3 292.423 2.731 20 70 CFIDHN CC(C)C[C@H](N)C(=O)NCC(C)(C)Cc1ccccc1 ZINC000159489758 378712628 /nfs/dbraw/zinc/71/26/28/378712628.db2.gz PRVVZOWDEKVCPE-HNNXBMFYSA-N 0 3 276.424 2.745 20 70 CFIDHN CCN1CCCN(C(=O)NCc2cccc(Cl)c2)CC1 ZINC000159510907 378714233 /nfs/dbraw/zinc/71/42/33/378714233.db2.gz ZCAYILLGUWKAOU-UHFFFAOYSA-N 0 3 295.814 2.577 20 70 CFIDHN CSCC[C@@H](N)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000159724497 378727943 /nfs/dbraw/zinc/72/79/43/378727943.db2.gz LDNIMBRCQPPYDU-KFWWJZLASA-N 0 3 292.448 2.519 20 70 CFIDHN CCSCCN(CC)Cc1ccc(C(=O)N(C)C)cc1 ZINC000160468463 378773805 /nfs/dbraw/zinc/77/38/05/378773805.db2.gz UCFDBCKFVHTORR-UHFFFAOYSA-N 0 3 294.464 2.963 20 70 CFIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)NC1CCCC1 ZINC000160533091 378778639 /nfs/dbraw/zinc/77/86/39/378778639.db2.gz KPDIDGMTQBDGOJ-STQMWFEESA-N 0 3 254.418 2.802 20 70 CFIDHN CCc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)s1 ZINC000160559708 378782089 /nfs/dbraw/zinc/78/20/89/378782089.db2.gz XGBVGMAGNYDWBC-JQWIXIFHSA-N 0 3 290.436 2.876 20 70 CFIDHN Cc1nc(C(C)C)sc1[C@@H](C)NCC(C)(C)O ZINC000160600268 378784427 /nfs/dbraw/zinc/78/44/27/378784427.db2.gz UETPNLVHIMBUHD-SECBINFHSA-N 0 3 256.415 2.996 20 70 CFIDHN CC(C)(O)CN[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000160630419 378786732 /nfs/dbraw/zinc/78/67/32/378786732.db2.gz SQONDVABWVDJGJ-CYBMUJFWSA-N 0 3 261.365 2.793 20 70 CFIDHN CC[C@H](N[C@H]1CCC(=O)N(C)C1)c1ccc(F)cc1F ZINC000161201491 378829641 /nfs/dbraw/zinc/82/96/41/378829641.db2.gz NEAPDGIMRFDDCU-FZMZJTMJSA-N 0 3 282.334 2.626 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@H](C)CCC1CCCCC1 ZINC000160916328 378810280 /nfs/dbraw/zinc/81/02/80/378810280.db2.gz IMIZHPGMFKFWRM-OCCSQVGLSA-N 0 3 286.485 2.932 20 70 CFIDHN Cc1ccc([C@@H](C)CN[C@@H](C(N)=O)c2ccccc2)cc1 ZINC000161051403 378818749 /nfs/dbraw/zinc/81/87/49/378818749.db2.gz XLARHNCQQOPUAI-WMLDXEAASA-N 0 3 282.387 2.915 20 70 CFIDHN CC[C@H](N)C(=O)Nc1cc(F)ccc1SCC(F)F ZINC000161130669 378824330 /nfs/dbraw/zinc/82/43/30/378824330.db2.gz QIFPZQMLVRQVOI-QMMMGPOBSA-N 0 3 292.326 2.859 20 70 CFIDHN CN(CCOc1ccc(Cl)cc1)CC1=CCCOC1 ZINC000161162917 378827294 /nfs/dbraw/zinc/82/72/94/378827294.db2.gz ZQIQGHJWQMJKNY-UHFFFAOYSA-N 0 3 281.783 2.997 20 70 CFIDHN CC(C)CCOc1ccc(NC(=O)C(C)(C)N)cc1 ZINC000161381221 378842626 /nfs/dbraw/zinc/84/26/26/378842626.db2.gz PCVPSZGBOLJBTH-UHFFFAOYSA-N 0 3 264.369 2.787 20 70 CFIDHN COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)[C@@H](C)N ZINC000161415817 378845919 /nfs/dbraw/zinc/84/59/19/378845919.db2.gz NYBZDQCZHCIBOV-ZWNOBZJWSA-N 0 3 298.814 2.899 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H]2C[C@@H]2C2CCCCC2)CC1 ZINC000159908946 285216203 /nfs/dbraw/zinc/21/62/03/285216203.db2.gz RKTGLLNPDOZQNJ-CVEARBPZSA-N 0 3 293.455 2.692 20 70 CFIDHN CC(C)(N)C(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000160080749 394366016 /nfs/dbraw/zinc/36/60/16/394366016.db2.gz ODNYLAXOVFNWIR-SNVBAGLBSA-N 0 3 287.190 2.834 20 70 CFIDHN C[C@@H]1CCC[C@@H](C(=O)NCCN2CCCCCC2)C1 ZINC000160222175 277701589 /nfs/dbraw/zinc/70/15/89/277701589.db2.gz XOLCUAVEMPATRO-HUUCEWRRSA-N 0 3 266.429 2.805 20 70 CFIDHN COC[C@@H](C)N[C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000161149814 292779423 /nfs/dbraw/zinc/77/94/23/292779423.db2.gz GIHYPISAXFJKKU-BZNIZROVSA-N 0 3 277.364 2.533 20 70 CFIDHN CCC(CC)CNC(=O)N(CCN(C)C)CC(C)C ZINC000160571838 322339413 /nfs/dbraw/zinc/33/94/13/322339413.db2.gz KBHPVZQMILMJIS-UHFFFAOYSA-N 0 3 271.449 2.652 20 70 CFIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)N1CCCCC1 ZINC000160585424 322340265 /nfs/dbraw/zinc/34/02/65/322340265.db2.gz VDJUWNDEOKWSBA-KGLIPLIRSA-N 0 3 254.418 2.755 20 70 CFIDHN CCOC[C@@H](O)CN[C@H](C)c1ccc(SCC)cc1 ZINC000159638112 322325731 /nfs/dbraw/zinc/32/57/31/322325731.db2.gz SWQAGQCJSGUYFA-OCCSQVGLSA-N 0 3 283.437 2.847 20 70 CFIDHN C[C@@H](NCCC(C)(C)C)c1nnnn1-c1ccccc1 ZINC000159881802 322329643 /nfs/dbraw/zinc/32/96/43/322329643.db2.gz SHRDVSQDCLSTTJ-GFCCVEGCSA-N 0 3 273.384 2.749 20 70 CFIDHN CC(C)N1CC[C@H](CNc2nnc(C(F)(F)F)s2)C1 ZINC000160166910 322333461 /nfs/dbraw/zinc/33/34/61/322333461.db2.gz FMHANQGLFOFLGJ-MRVPVSSYSA-N 0 3 294.346 2.699 20 70 CFIDHN C[C@H]1C[C@@H](NC(=O)C2CCC(C)(C)CC2)CN1C1CC1 ZINC000161105757 322347745 /nfs/dbraw/zinc/34/77/45/322347745.db2.gz QTGLZDHKLQFNKF-GXTWGEPZSA-N 0 3 278.440 2.944 20 70 CFIDHN CC(C)(C)CN(CCCO)Cc1cnc2ccccn12 ZINC000160223047 518663160 /nfs/dbraw/zinc/66/31/60/518663160.db2.gz OFQYMPDVANWACV-UHFFFAOYSA-N 0 3 275.396 2.565 20 70 CFIDHN CC[C@@H](C)c1cc(C(=O)NCCN2CCCCCC2)on1 ZINC000160223808 522417828 /nfs/dbraw/zinc/41/78/28/522417828.db2.gz ICSLJJAGHLQXJC-CYBMUJFWSA-N 0 3 293.411 2.794 20 70 CFIDHN CN1CCC[C@@H]2CN(c3nc(C(C)(C)C)ns3)CC[C@H]21 ZINC000159998555 523834861 /nfs/dbraw/zinc/83/48/61/523834861.db2.gz BHDMMAAFNSVCRH-VXGBXAGGSA-N 0 3 294.468 2.756 20 70 CFIDHN CC[C@H](C)NC(=O)CCNCc1coc2ccccc12 ZINC000159820648 523968822 /nfs/dbraw/zinc/96/88/22/523968822.db2.gz FQKGVRHBGWCZGE-LBPRGKRZSA-N 0 3 274.364 2.827 20 70 CFIDHN C[C@@H](CN1CCCC1=O)NCc1coc2ccccc12 ZINC000161092860 524599583 /nfs/dbraw/zinc/59/95/83/524599583.db2.gz ZDGZRQZUNFQFES-LBPRGKRZSA-N 0 3 272.348 2.533 20 70 CFIDHN C[C@H]1C[C@@H](N(C)c2nc(C(C)(C)C)ns2)CCN1C ZINC000159624651 524786083 /nfs/dbraw/zinc/78/60/83/524786083.db2.gz MHUHMTQUFZENDL-QWRGUYRKSA-N 0 3 282.457 2.755 20 70 CFIDHN COc1ccc([C@@H](C)NCC2(CO)CCCC2)c(OC)c1 ZINC000160073695 525146701 /nfs/dbraw/zinc/14/67/01/525146701.db2.gz WMNVFFSFGMQPRX-CYBMUJFWSA-N 0 3 293.407 2.907 20 70 CFIDHN CSCCCCC(=O)NCCN1CCCC[C@@H]1C ZINC000159898293 525401614 /nfs/dbraw/zinc/40/16/14/525401614.db2.gz YXMGIMPNTJCHCT-ZDUSSCGKSA-N 0 3 272.458 2.510 20 70 CFIDHN NC(=O)c1cccc(CNCCc2ccc(Cl)s2)c1 ZINC000218153658 527079855 /nfs/dbraw/zinc/07/98/55/527079855.db2.gz YIBAPJUCKPUORX-UHFFFAOYSA-N 0 3 294.807 2.833 20 70 CFIDHN Cc1nc2ccccn2c1CN(C)C[C@@H]1CCCOC1 ZINC000160246949 527176191 /nfs/dbraw/zinc/17/61/91/527176191.db2.gz WYVRSCOSACWDJY-AWEZNQCLSA-N 0 3 273.380 2.501 20 70 CFIDHN O=c1[nH]c2ccccc2cc1CNCC1(CO)CCCC1 ZINC000160088791 527524166 /nfs/dbraw/zinc/52/41/66/527524166.db2.gz BLTQZSKGOOUTEA-UHFFFAOYSA-N 0 3 286.375 2.583 20 70 CFIDHN CCNC(=O)C(C)(C)CNc1ccnc2ccccc21 ZINC000161374206 528025528 /nfs/dbraw/zinc/02/55/28/528025528.db2.gz ALKXOHLBENCSLS-UHFFFAOYSA-N 0 3 271.364 2.809 20 70 CFIDHN CCN1CCC[C@@H]1CNC(=O)CCCc1sccc1C ZINC000159906701 529078569 /nfs/dbraw/zinc/07/85/69/529078569.db2.gz HHWGONFXCIPHQZ-CQSZACIVSA-N 0 3 294.464 2.980 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccccc1C)CC2 ZINC000159596794 282127409 /nfs/dbraw/zinc/12/74/09/282127409.db2.gz HZTHAJRQXJHSNO-TZMCWYRMSA-N 0 3 270.380 2.561 20 70 CFIDHN CC[C@H](C)C[C@@H](C)NC(=O)N1CCCN(CC)CC1 ZINC000159920057 529676776 /nfs/dbraw/zinc/67/67/76/529676776.db2.gz YATOMHLFGCRKBE-UONOGXRCSA-N 0 3 269.433 2.548 20 70 CFIDHN CN(Cc1ccco1)C(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000160567606 348018979 /nfs/dbraw/zinc/01/89/79/348018979.db2.gz CFKRDSXMUPNUSI-ZFWWWQNUSA-N 0 3 276.380 2.503 20 70 CFIDHN CCN(CCN[C@@H]1CCCc2cccnc21)C1CC1 ZINC000217482789 539644172 /nfs/dbraw/zinc/64/41/72/539644172.db2.gz BCHYFTQEEKOWSW-OAHLLOKOSA-N 0 3 259.397 2.533 20 70 CFIDHN CC(=O)Nc1ccccc1CNCCNc1cccc(C)n1 ZINC000160540558 541431565 /nfs/dbraw/zinc/43/15/65/541431565.db2.gz SIULMKBOSMRYDY-UHFFFAOYSA-N 0 3 298.390 2.550 20 70 CFIDHN CCN1CCC(NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1 ZINC000159912235 378737822 /nfs/dbraw/zinc/73/78/22/378737822.db2.gz FTCKFDNGDLWQGB-ZIAGYGMSSA-N 0 3 292.448 2.761 20 70 CFIDHN CC1(C)C[C@H](NCc2cn3ccccc3n2)C(C)(C)O1 ZINC000159434728 378709087 /nfs/dbraw/zinc/70/90/87/378709087.db2.gz FKTJRHFCZIPWCR-ZDUSSCGKSA-N 0 3 273.380 2.770 20 70 CFIDHN CC[C@H](N)C(=O)NCCCc1ccc(C(C)C)cc1 ZINC000159607960 378719890 /nfs/dbraw/zinc/71/98/90/378719890.db2.gz QNNGACDGBXZJNS-HNNXBMFYSA-N 0 3 262.397 2.596 20 70 CFIDHN COc1cc([C@@H](C)NCCO)ccc1SC(F)F ZINC000159714102 378726244 /nfs/dbraw/zinc/72/62/44/378726244.db2.gz SKIVCAJPORCNBP-MRVPVSSYSA-N 0 3 277.336 2.653 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000159721825 378726416 /nfs/dbraw/zinc/72/64/16/378726416.db2.gz MFVHNVDHLDAEBG-ILXRZTDVSA-N 0 3 260.381 2.566 20 70 CFIDHN Cc1cccc(C)c1CCNC(=O)[C@@H](N)Cc1ccccc1 ZINC000160206473 378756542 /nfs/dbraw/zinc/75/65/42/378756542.db2.gz YAAAVCJEVYOYAZ-SFHVURJKSA-N 0 3 296.414 2.532 20 70 CFIDHN CCN(CC)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000159848588 378734235 /nfs/dbraw/zinc/73/42/35/378734235.db2.gz MMDAROKOPLTGSQ-GDBMZVCRSA-N 0 3 289.423 2.701 20 70 CFIDHN CC[C@@H](C)[C@H](N)C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000160344572 378765303 /nfs/dbraw/zinc/76/53/03/378765303.db2.gz QTJYJCOCLKCQCT-KYOSRNDESA-N 0 3 290.407 2.778 20 70 CFIDHN CC(C)CN1CCC[C@@H]1CNC(=O)c1ccc(Cl)o1 ZINC000160422032 378772003 /nfs/dbraw/zinc/77/20/03/378772003.db2.gz NLIHUSYDWTVSRB-LLVKDONJSA-N 0 3 284.787 2.783 20 70 CFIDHN CSc1ccc([C@@H](C)NCC(C)(C)O)cc1F ZINC000160609767 378786041 /nfs/dbraw/zinc/78/60/41/378786041.db2.gz GNCRRGRWROSHBN-SECBINFHSA-N 0 3 257.374 2.969 20 70 CFIDHN Cc1csc(CCCCN[C@@H](C)c2cnccn2)n1 ZINC000160668388 378789773 /nfs/dbraw/zinc/78/97/73/378789773.db2.gz ZJYSTHLEVKYHMG-LBPRGKRZSA-N 0 3 276.409 2.915 20 70 CFIDHN CC[C@@H](NCCNC(=O)c1ccco1)c1ccc(F)cc1 ZINC000160712620 378792763 /nfs/dbraw/zinc/79/27/63/378792763.db2.gz HAUYRKWPIMHGPN-CQSZACIVSA-N 0 3 290.338 2.889 20 70 CFIDHN COc1cccc([C@@H](O)CN[C@H](C)c2ccco2)c1 ZINC000160790889 378798397 /nfs/dbraw/zinc/79/83/97/378798397.db2.gz DUZDQQYBPNTQDK-RISCZKNCSA-N 0 3 261.321 2.672 20 70 CFIDHN COC(CN1C[C@@H](C)C[C@H]1c1cccc(F)c1)OC ZINC000161271506 378836142 /nfs/dbraw/zinc/83/61/42/378836142.db2.gz LRHPOJPLFVQBHN-FZMZJTMJSA-N 0 3 267.344 2.828 20 70 CFIDHN CC[C@H](NC(=O)[C@H](N)C(C)C)c1ccc(F)cc1F ZINC000161209808 378831394 /nfs/dbraw/zinc/83/13/94/378831394.db2.gz BGFKKJSQVLRMIO-QWHCGFSZSA-N 0 3 270.323 2.515 20 70 CFIDHN CC[C@@H](C)OCC(=O)Nc1cc(CN(C)C)ccc1C ZINC000160942435 378811716 /nfs/dbraw/zinc/81/17/16/378811716.db2.gz RNPWXBTWHJTDGC-CYBMUJFWSA-N 0 3 278.396 2.810 20 70 CFIDHN CCC[C@@H](N)C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 ZINC000161055079 378818427 /nfs/dbraw/zinc/81/84/27/378818427.db2.gz TYMSFHKSOZJNNX-OAGGEKHMSA-N 0 3 274.408 2.641 20 70 CFIDHN CN(Cc1cc2ccccc2o1)C(=O)[C@H]1CCCCN1 ZINC000161413498 378844122 /nfs/dbraw/zinc/84/41/22/378844122.db2.gz SGOJQKNGGGHIHB-CQSZACIVSA-N 0 3 272.348 2.533 20 70 CFIDHN CC(C)C[C@H](N)C(=O)NC[C@@H](C)Oc1cccc(Cl)c1 ZINC000161402893 378845059 /nfs/dbraw/zinc/84/50/59/378845059.db2.gz FESLBNGERRIKFR-RISCZKNCSA-N 0 3 298.814 2.597 20 70 CFIDHN Cc1ccc(-n2nc(C(C)C)cc2NC(=O)[C@H](C)N)cc1 ZINC000161295571 378837815 /nfs/dbraw/zinc/83/78/15/378837815.db2.gz BKFFHUDBNRXFRM-LBPRGKRZSA-N 0 3 286.379 2.590 20 70 CFIDHN CCCN(CCO)Cc1ccccc1OCC1CC1 ZINC000161224052 322349291 /nfs/dbraw/zinc/34/92/91/322349291.db2.gz WUZASUKQYLALRV-UHFFFAOYSA-N 0 3 263.381 2.680 20 70 CFIDHN CCN(C[C@@H](O)c1ccc(C)cc1)C[C@@H]1CCCO1 ZINC000216952878 382785261 /nfs/dbraw/zinc/78/52/61/382785261.db2.gz KHXBDEPDKUYHDF-JKSUJKDBSA-N 0 3 263.381 2.529 20 70 CFIDHN CN1CCC[C@@H]1CNCc1nc(-c2ccccc2)cs1 ZINC000218235845 382790034 /nfs/dbraw/zinc/79/00/34/382790034.db2.gz FFYAVBPYSGCKLN-CQSZACIVSA-N 0 3 287.432 2.994 20 70 CFIDHN Cc1cc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)c(C)s1 ZINC000160332726 394366640 /nfs/dbraw/zinc/36/66/40/394366640.db2.gz FVRANQVEUGJKTC-ZWNOBZJWSA-N 0 3 290.436 2.930 20 70 CFIDHN CC(C)(O)CN[C@@H]1CCCOc2ccc(Cl)cc21 ZINC000160591433 278649321 /nfs/dbraw/zinc/64/93/21/278649321.db2.gz QPJHITUNZSAHRV-GFCCVEGCSA-N 0 3 269.772 2.914 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)CC1 ZINC000159516886 279286274 /nfs/dbraw/zinc/28/62/74/279286274.db2.gz DIIDRCNDKJLFRO-SOUVJXGZSA-N 0 3 281.444 2.548 20 70 CFIDHN C[C@H]1CC[C@@H](C(N)=O)CN1Cc1cc2cc(F)ccc2o1 ZINC000159521716 322324010 /nfs/dbraw/zinc/32/40/10/322324010.db2.gz YZCCIGWRBKYGJT-WDEREUQCSA-N 0 3 290.338 2.658 20 70 CFIDHN CCN1CCC[C@@H]1CNC(=O)[C@@H](C)OC1CCCCCC1 ZINC000159572627 322324485 /nfs/dbraw/zinc/32/44/85/322324485.db2.gz KDWHLXRROFUJBC-HUUCEWRRSA-N 0 3 296.455 2.715 20 70 CFIDHN Cc1ccccc1[C@@H](C)NCCOC[C@@H]1CCCO1 ZINC000159643975 322325645 /nfs/dbraw/zinc/32/56/45/322325645.db2.gz UEGGNUXHICDCSL-CABCVRRESA-N 0 3 263.381 2.841 20 70 CFIDHN Cc1cccc([C@@H](C)C(=O)NCCN2CCC[C@H](C)C2)c1 ZINC000159903736 322329810 /nfs/dbraw/zinc/32/98/10/322329810.db2.gz AMWNOSMAEZXXQP-JKSUJKDBSA-N 0 3 288.435 2.947 20 70 CFIDHN C/C(=C/c1ccc(Cl)cc1)CNCCNC(=O)C1CC1 ZINC000159887254 322329965 /nfs/dbraw/zinc/32/99/65/322329965.db2.gz MFOWHXCVCMNMLS-BENRWUELSA-N 0 3 292.810 2.859 20 70 CFIDHN C[C@H](N[C@@H]1CCN(CC(F)(F)F)C1)c1ccco1 ZINC000160223239 322334584 /nfs/dbraw/zinc/33/45/84/322334584.db2.gz XKPGSONTIPYUOF-VHSXEESVSA-N 0 3 262.275 2.567 20 70 CFIDHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)NC1CCN(C)CC1 ZINC000160244864 322335358 /nfs/dbraw/zinc/33/53/58/322335358.db2.gz KRWHLSLYYQAAQH-LBPRGKRZSA-N 0 3 294.826 2.729 20 70 CFIDHN CC(C)CN(CCCS(=O)(=O)C(C)C)CC(C)C ZINC000160797950 322343165 /nfs/dbraw/zinc/34/31/65/322343165.db2.gz ZUDHRHWZXWTJHJ-UHFFFAOYSA-N 0 3 277.474 2.814 20 70 CFIDHN C[C@H](NC[C@@H]1CCc2ccccc21)c1cnccn1 ZINC000160972897 322345458 /nfs/dbraw/zinc/34/54/58/322345458.db2.gz WGKSUKLEADHCLC-JSGCOSHPSA-N 0 3 253.349 2.857 20 70 CFIDHN CC(C)CC[C@](C)(O)CN[C@H](C)c1cncs1 ZINC000159366109 519695903 /nfs/dbraw/zinc/69/59/03/519695903.db2.gz MRGPMLHPNGRZGC-YPMHNXCESA-N 0 3 256.415 2.981 20 70 CFIDHN CC1(C)C[C@H](NCC[S@@](=O)c2ccccc2)C(C)(C)O1 ZINC000160787668 520554406 /nfs/dbraw/zinc/55/44/06/520554406.db2.gz JALFFFIYLOPXHO-XOBRGWDASA-N 0 3 295.448 2.730 20 70 CFIDHN CCCCSCCC(=O)NCCN1CCCC[C@@H]1C ZINC000159894647 520951525 /nfs/dbraw/zinc/95/15/25/520951525.db2.gz MYZGDMIEIBFPFE-AWEZNQCLSA-N 0 3 286.485 2.900 20 70 CFIDHN COC[C@H](C)NCc1cccc(-c2ccccn2)c1 ZINC000159742820 522626822 /nfs/dbraw/zinc/62/68/22/522626822.db2.gz KQOFPSSELALENL-ZDUSSCGKSA-N 0 3 256.349 2.873 20 70 CFIDHN COc1ccc(CNCc2cccc3cc[nH]c32)cn1 ZINC000218091564 524073487 /nfs/dbraw/zinc/07/34/87/524073487.db2.gz WLNXZYNNNVIYBJ-UHFFFAOYSA-N 0 3 267.332 2.861 20 70 CFIDHN C[C@@H]1CC[C@H](C(N)=O)CN1Cc1cnc(C(C)(C)C)s1 ZINC000159645662 524646328 /nfs/dbraw/zinc/64/63/28/524646328.db2.gz ILNOCXCICGYIEH-MNOVXSKESA-N 0 3 295.452 2.526 20 70 CFIDHN COc1ccc(OC)c([C@H](C)NCC2(CO)CCCC2)c1 ZINC000160108794 524903909 /nfs/dbraw/zinc/90/39/09/524903909.db2.gz ONWLLRYIUHIBCA-ZDUSSCGKSA-N 0 3 293.407 2.907 20 70 CFIDHN C[C@@H](O)C(C)(C)NCc1ccc(Br)s1 ZINC000160601429 525745311 /nfs/dbraw/zinc/74/53/11/525745311.db2.gz SJUNIUWDWJSSFL-SSDOTTSWSA-N 0 3 278.215 2.760 20 70 CFIDHN C[C@@H](O)C(C)(C)NCc1ccccc1Br ZINC000160626927 525745528 /nfs/dbraw/zinc/74/55/28/525745528.db2.gz YTRMSXJCQKVWDT-SECBINFHSA-N 0 3 272.186 2.698 20 70 CFIDHN CCCCN1CCCC[C@@H]1CNC(=O)C1(CCOC)CC1 ZINC000161183016 528464874 /nfs/dbraw/zinc/46/48/74/528464874.db2.gz HNKIDYQNVSOSSS-OAHLLOKOSA-N 0 3 296.455 2.574 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H](C)CCCC(C)C)CC1 ZINC000159510582 529028844 /nfs/dbraw/zinc/02/88/44/529028844.db2.gz RGKITKSMTOIPRJ-HNNXBMFYSA-N 0 3 283.460 2.938 20 70 CFIDHN CC(C)[C@@H]1CCCCN1C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160625134 348019046 /nfs/dbraw/zinc/01/90/46/348019046.db2.gz WQARAVSITYZTDG-CVEARBPZSA-N 0 3 293.455 2.691 20 70 CFIDHN Cc1nccc(NC(=O)N(C)CCN2CCCC2)c1Cl ZINC000159492640 540995705 /nfs/dbraw/zinc/99/57/05/540995705.db2.gz PBUYWLJWFDONBJ-UHFFFAOYSA-N 0 3 296.802 2.603 20 70 CFIDHN CSCC[C@@H](N)C(=O)N1CCCC2(CCCCC2)C1 ZINC000159859515 378735121 /nfs/dbraw/zinc/73/51/21/378735121.db2.gz VKFVASJERNJAMB-CYBMUJFWSA-N 0 3 284.469 2.640 20 70 CFIDHN CC(C)OC(=O)CCN(C)Cc1cccc(N(C)C)c1 ZINC000159885620 378735305 /nfs/dbraw/zinc/73/53/05/378735305.db2.gz MUDXHIJQNRMEJL-UHFFFAOYSA-N 0 3 278.396 2.526 20 70 CFIDHN CCCN(C)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000159903777 378737622 /nfs/dbraw/zinc/73/76/22/378737622.db2.gz CHERWLBMVPFNNH-GOEBONIOSA-N 0 3 289.423 2.701 20 70 CFIDHN CCN1CCC(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)CC1 ZINC000159911980 378737693 /nfs/dbraw/zinc/73/76/93/378737693.db2.gz FTCKFDNGDLWQGB-UONOGXRCSA-N 0 3 292.448 2.761 20 70 CFIDHN C[C@@H](NC[C@](C)(O)c1ccsc1)c1cncs1 ZINC000159959393 378740285 /nfs/dbraw/zinc/74/02/85/378740285.db2.gz GJSJPTUFXCHILP-SKDRFNHKSA-N 0 3 268.407 2.763 20 70 CFIDHN CN1CC[C@H]2[C@@H](CCCN2c2nc(C(C)(C)C)ns2)C1 ZINC000160022717 378743986 /nfs/dbraw/zinc/74/39/86/378743986.db2.gz RBBFRPDLTRZEKN-RYUDHWBXSA-N 0 3 294.468 2.756 20 70 CFIDHN C[C@@]1(c2ccccc2)CCCN(C(=O)[C@@H]2CCCCN2)C1 ZINC000160101655 378748176 /nfs/dbraw/zinc/74/81/76/378748176.db2.gz FMMPMSHSWKMAOQ-FUHWJXTLSA-N 0 3 286.419 2.709 20 70 CFIDHN CCc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)o1 ZINC000159595817 378718708 /nfs/dbraw/zinc/71/87/08/378718708.db2.gz XXPZYUMOZCROQU-KKUMJFAQSA-N 0 3 261.365 2.889 20 70 CFIDHN C[C@@H](c1ccc(F)c(F)c1)N(C)CCn1ccnc1 ZINC000159709476 378725938 /nfs/dbraw/zinc/72/59/38/378725938.db2.gz LHWCJTQQNIGKNK-NSHDSACASA-N 0 3 265.307 2.854 20 70 CFIDHN C[C@@H]1C[C@@H](NC(=O)NC(C)(C)C)CN1Cc1ccccc1 ZINC000160380900 378768845 /nfs/dbraw/zinc/76/88/45/378768845.db2.gz LEHPUYOQHDYEJS-UKRRQHHQSA-N 0 3 289.423 2.747 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(C)c(C)c1)CC2 ZINC000160414346 378770802 /nfs/dbraw/zinc/77/08/02/378770802.db2.gz XURVSWYOEZYOHA-CJNGLKHVSA-N 0 3 284.407 2.869 20 70 CFIDHN CCc1ccc(/C=C/C(=O)N(C)[C@@H]2CCN(C)[C@H](C)C2)o1 ZINC000160421711 378772664 /nfs/dbraw/zinc/77/26/64/378772664.db2.gz YTPASTQOPFHZDV-SJXIGLKTSA-N 0 3 290.407 2.796 20 70 CFIDHN COc1ccc(OC)c(CN[C@H]2CCOC(C)(C)C2)c1 ZINC000160461959 378773523 /nfs/dbraw/zinc/77/35/23/378773523.db2.gz OUVAMFRIHFDCNG-ZDUSSCGKSA-N 0 3 279.380 2.751 20 70 CFIDHN Cc1nc(C(C)C)sc1[C@H](C)NCC(C)(C)O ZINC000160600389 378784990 /nfs/dbraw/zinc/78/49/90/378784990.db2.gz UETPNLVHIMBUHD-VIFPVBQESA-N 0 3 256.415 2.996 20 70 CFIDHN CCCOc1ccc(OCCN2CCC(C)(O)CC2)cc1 ZINC000161221710 378830832 /nfs/dbraw/zinc/83/08/32/378830832.db2.gz BMYJOUZEBDGDCF-UHFFFAOYSA-N 0 3 293.407 2.701 20 70 CFIDHN C[C@H](CN[C@H](C)c1cnccn1)N(C)Cc1ccccc1 ZINC000160864386 378803615 /nfs/dbraw/zinc/80/36/15/378803615.db2.gz IPVRAQYKWIQQGC-HUUCEWRRSA-N 0 3 284.407 2.648 20 70 CFIDHN C[C@@H](CN[C@@H](C)c1cnccn1)N(C)Cc1ccccc1 ZINC000160864026 378804011 /nfs/dbraw/zinc/80/40/11/378804011.db2.gz IPVRAQYKWIQQGC-GJZGRUSLSA-N 0 3 284.407 2.648 20 70 CFIDHN C[C@H](CN[C@@H](C)c1cnccn1)N(C)Cc1ccccc1 ZINC000160864157 378804352 /nfs/dbraw/zinc/80/43/52/378804352.db2.gz IPVRAQYKWIQQGC-CABCVRRESA-N 0 3 284.407 2.648 20 70 CFIDHN CC[C@@H](C)NC(=O)CCNCc1cc(F)cc(Cl)c1 ZINC000160905127 378808078 /nfs/dbraw/zinc/80/80/78/378808078.db2.gz NZZFNNYPEBUBCX-SNVBAGLBSA-N 0 3 286.778 2.874 20 70 CFIDHN CCC[C@H](NCC(=O)NC(C)C)c1ccc(OC)cc1 ZINC000160917450 378809284 /nfs/dbraw/zinc/80/92/84/378809284.db2.gz PKFGQIYVTSZTBC-HNNXBMFYSA-N 0 3 278.396 2.651 20 70 CFIDHN Cc1c(NC(=O)[C@]2(F)CCNC2)sc2c1CCCC2 ZINC000160989090 378814916 /nfs/dbraw/zinc/81/49/16/378814916.db2.gz RMWBSRRWUSNBRL-AWEZNQCLSA-N 0 3 282.384 2.575 20 70 CFIDHN Cc1ccc(C(=O)CCN(C)C[C@H]2CCC[C@@H]2O)cc1 ZINC000161030850 378816579 /nfs/dbraw/zinc/81/65/79/378816579.db2.gz CXTCKACKXZJQKI-CVEARBPZSA-N 0 3 275.392 2.661 20 70 CFIDHN CCN(C(=O)[C@@H](C)N)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000161115725 378822781 /nfs/dbraw/zinc/82/27/81/378822781.db2.gz GNTHBRXZKWXSPI-NXEZZACHSA-N 0 3 288.313 2.962 20 70 CFIDHN CC[C@H](N)C(=O)Nc1ccc(OCC(F)(F)F)c(C)c1 ZINC000161118466 378823307 /nfs/dbraw/zinc/82/33/07/378823307.db2.gz IESVRUHLXVZDCL-JTQLQIEISA-N 0 3 290.285 2.612 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000161151946 378826170 /nfs/dbraw/zinc/82/61/70/378826170.db2.gz QCLUMPYVQIRWJI-UFBFGSQYSA-N 0 3 272.751 2.784 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@H](C)c1ccc(F)cc1Cl ZINC000161152177 378826424 /nfs/dbraw/zinc/82/64/24/378826424.db2.gz QCLUMPYVQIRWJI-PELKAZGASA-N 0 3 272.751 2.784 20 70 CFIDHN Cc1nc(C(C)(C)C)sc1[C@H](C)N[C@@H](C)CC(N)=O ZINC000161363370 378841046 /nfs/dbraw/zinc/84/10/46/378841046.db2.gz WHXBZOLHGYQJBW-IUCAKERBSA-N 0 3 283.441 2.664 20 70 CFIDHN C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](N)C(C)(C)C ZINC000161421478 378846123 /nfs/dbraw/zinc/84/61/23/378846123.db2.gz POXOXIYPCFAEPZ-AEGPPILISA-N 0 3 274.408 2.764 20 70 CFIDHN CSC[C@](C)(O)CNCc1ccc2c(c1)CC(C)(C)O2 ZINC000217841093 382787809 /nfs/dbraw/zinc/78/78/09/382787809.db2.gz ZTIUEHPPZFVNOP-MRXNPFEDSA-N 0 3 295.448 2.604 20 70 CFIDHN C[C@@H](NCc1cccc2cc[nH]c21)C(=O)NC(C)(C)C ZINC000218157411 382789280 /nfs/dbraw/zinc/78/92/80/382789280.db2.gz FLTLOLIMMWSREN-LLVKDONJSA-N 0 3 273.380 2.561 20 70 CFIDHN Cc1cccc(OCCN(C)C[C@H](O)Cc2ccccc2)c1 ZINC000218763841 393758398 /nfs/dbraw/zinc/75/83/98/393758398.db2.gz NFFRCLXXYQUTLR-GOSISDBHSA-N 0 3 299.414 2.909 20 70 CFIDHN CC[C@H](N)C(=O)N1CCCC[C@@H]1c1ccc(C)cc1 ZINC000159913046 394366034 /nfs/dbraw/zinc/36/60/34/394366034.db2.gz HEQHISUMHPVZHC-LSDHHAIUSA-N 0 3 260.381 2.786 20 70 CFIDHN COc1ccc(C)cc1CNCCNC(=O)OC(C)(C)C ZINC000218144502 397620960 /nfs/dbraw/zinc/62/09/60/397620960.db2.gz BDTPHEJADAPTOZ-UHFFFAOYSA-N 0 3 294.395 2.618 20 70 CFIDHN COC(CN1CCC(c2ccccc2C)CC1)OC ZINC000160993475 274012373 /nfs/dbraw/zinc/01/23/73/274012373.db2.gz AZYFHRVMTGLJBD-UHFFFAOYSA-N 0 3 263.381 2.793 20 70 CFIDHN CC(C)N1CC[C@H](N[C@H]2CCCc3cc(F)ccc32)C1=O ZINC000159543660 275644505 /nfs/dbraw/zinc/64/45/05/275644505.db2.gz XUNMKYKPQAKHTN-HOTGVXAUSA-N 0 3 290.382 2.802 20 70 CFIDHN CC(C)(O)CN[C@H]1CC2(CCC2)Oc2ccccc21 ZINC000160630548 275865712 /nfs/dbraw/zinc/86/57/12/275865712.db2.gz SQONDVABWVDJGJ-ZDUSSCGKSA-N 0 3 261.365 2.793 20 70 CFIDHN CC[C@H](COC)N[C@H](C)c1ccc(S(=O)(=O)CC)cc1 ZINC000159612597 287891254 /nfs/dbraw/zinc/89/12/54/287891254.db2.gz HRABSWQEOAQVOY-TZMCWYRMSA-N 0 3 299.436 2.556 20 70 CFIDHN CC(C)C[C@@H]1CCN(C(=O)C2(N)CCCCC2)C1 ZINC000159613076 279028048 /nfs/dbraw/zinc/02/80/48/279028048.db2.gz OBQBFGVLDFNTME-ZDUSSCGKSA-N 0 3 252.402 2.543 20 70 CFIDHN C[C@H](CN1CCCCC1)NC(=O)NCC1(C2CC2)CCC1 ZINC000159612880 322325011 /nfs/dbraw/zinc/32/50/11/322325011.db2.gz DOHXWNRYGCITLC-CQSZACIVSA-N 0 3 293.455 2.740 20 70 CFIDHN CC(C)C(=O)NCCCN[C@H](C)c1cc(F)ccc1F ZINC000159999643 322331442 /nfs/dbraw/zinc/33/14/42/322331442.db2.gz TWEGJKWCEZIMMF-LLVKDONJSA-N 0 3 284.350 2.778 20 70 CFIDHN CCCCNC(=O)CCN1CCC[C@H]1c1cccc(C)n1 ZINC000160393485 322337606 /nfs/dbraw/zinc/33/76/06/322337606.db2.gz IDMWQAUJDUIPIY-INIZCTEOSA-N 0 3 289.423 2.833 20 70 CFIDHN CN(C(=O)C1CCC(C)(C)CC1)[C@H]1CCCN(C)C1 ZINC000160678891 322341009 /nfs/dbraw/zinc/34/10/09/322341009.db2.gz DHUSONYMSBPGGT-AWEZNQCLSA-N 0 3 266.429 2.755 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@@H]1CCC[C@H](C)C1 ZINC000160795487 322342987 /nfs/dbraw/zinc/34/29/87/322342987.db2.gz JWLSDGDIUFPGND-UONOGXRCSA-N 0 3 275.458 2.710 20 70 CFIDHN C[C@H](c1cccnc1)N(C)C(=O)c1ccc(CN(C)C)cc1 ZINC000161493775 322352515 /nfs/dbraw/zinc/35/25/15/322352515.db2.gz YKTKLKVCNRYURP-CQSZACIVSA-N 0 3 297.402 2.976 20 70 CFIDHN CCCCC[C@@H](C)NC(=O)N1CCCN(CC)CC1 ZINC000159512468 520283042 /nfs/dbraw/zinc/28/30/42/520283042.db2.gz GWJUHVBWXRJAEY-CQSZACIVSA-N 0 3 269.433 2.692 20 70 CFIDHN CC(C)(C)NC(=O)CCNCc1cc(F)cc(Cl)c1 ZINC000160982069 518724242 /nfs/dbraw/zinc/72/42/42/518724242.db2.gz YHPAJDYIXSQVSR-UHFFFAOYSA-N 0 3 286.778 2.874 20 70 CFIDHN CCOC[C@H]1CCN(Cc2c(C)nc3ccccn32)C1 ZINC000160944336 520179987 /nfs/dbraw/zinc/17/99/87/520179987.db2.gz ULFULOXXCXYAFF-AWEZNQCLSA-N 0 3 273.380 2.501 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H](C)CCC(C)C)CC1 ZINC000159514406 521608190 /nfs/dbraw/zinc/60/81/90/521608190.db2.gz LAVXDAIMJLUBGY-AWEZNQCLSA-N 0 3 269.433 2.548 20 70 CFIDHN CC[C@@H](C)NC(=O)CCNCc1coc2ccccc12 ZINC000159820517 522153878 /nfs/dbraw/zinc/15/38/78/522153878.db2.gz FQKGVRHBGWCZGE-GFCCVEGCSA-N 0 3 274.364 2.827 20 70 CFIDHN COc1cc([C@@H](C)NCCN2CCSCC2)ccc1F ZINC000218248138 522904815 /nfs/dbraw/zinc/90/48/15/522904815.db2.gz WHNIPGMXJKCYHH-GFCCVEGCSA-N 0 3 298.427 2.534 20 70 CFIDHN COCc1cccc(CNC[C@H]2CCC(C)(C)O2)c1 ZINC000160226663 523053961 /nfs/dbraw/zinc/05/39/61/523053961.db2.gz MZOKZHSGQSFRKP-OAHLLOKOSA-N 0 3 263.381 2.880 20 70 CFIDHN Cc1cc(CN2CC[C@@H](O)[C@H](C)C2)c2ccccc2n1 ZINC000159398029 524703011 /nfs/dbraw/zinc/70/30/11/524703011.db2.gz FRVRENSSHHKMOF-SJKOYZFVSA-N 0 3 270.376 2.746 20 70 CFIDHN Cc1cccc([C@@H]2CCCN2C[C@H](O)COCC(C)C)n1 ZINC000160111311 524851001 /nfs/dbraw/zinc/85/10/01/524851001.db2.gz GZYOVYZHTVKBKN-RDJZCZTQSA-N 0 3 292.423 2.560 20 70 CFIDHN Cc1nc(C(C)(C)C)sc1[C@@H](C)N[C@@H](C)CC(N)=O ZINC000161363227 526661493 /nfs/dbraw/zinc/66/14/93/526661493.db2.gz WHXBZOLHGYQJBW-DTWKUNHWSA-N 0 3 283.441 2.664 20 70 CFIDHN CCCCN1CCCC[C@H]1CNC(=O)C1(CCOC)CC1 ZINC000161183149 528469090 /nfs/dbraw/zinc/46/90/90/528469090.db2.gz HNKIDYQNVSOSSS-HNNXBMFYSA-N 0 3 296.455 2.574 20 70 CFIDHN CCN1CCC[C@H]1CNC(=O)CCCc1sccc1C ZINC000159906834 529102951 /nfs/dbraw/zinc/10/29/51/529102951.db2.gz HHWGONFXCIPHQZ-AWEZNQCLSA-N 0 3 294.464 2.980 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cc(C)cc(C)c1)CC2 ZINC000160304346 282118561 /nfs/dbraw/zinc/11/85/61/282118561.db2.gz WAUHNLWUTJDOFP-CJNGLKHVSA-N 0 3 284.407 2.869 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cc(C)cc(C)c1)CC2 ZINC000160304222 282125654 /nfs/dbraw/zinc/12/56/54/282125654.db2.gz WAUHNLWUTJDOFP-XJKSGUPXSA-N 0 3 284.407 2.869 20 70 CFIDHN CSc1ccc([C@H](C)NCC(C)(C)O)cc1F ZINC000160609640 188483097 /nfs/dbraw/zinc/48/30/97/188483097.db2.gz GNCRRGRWROSHBN-VIFPVBQESA-N 0 3 257.374 2.969 20 70 CFIDHN CCC(C)(CC)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21 ZINC000159494903 540996476 /nfs/dbraw/zinc/99/64/76/540996476.db2.gz XQJIEEXZKPVZFY-UONOGXRCSA-N 0 3 266.429 2.755 20 70 CFIDHN CCn1nccc1CNC[C@@H]1CCN(c2ccccc2)C1 ZINC000159975374 541019194 /nfs/dbraw/zinc/01/91/94/541019194.db2.gz NBQZAJHMKHUIJY-HNNXBMFYSA-N 0 3 284.407 2.519 20 70 CFIDHN CC[C@H](C(=O)NC1CCC(C(C)C)CC1)N(C)C ZINC000161244265 541570899 /nfs/dbraw/zinc/57/08/99/541570899.db2.gz HURQDOFMEORGFN-JXQTWKCFSA-N 0 3 254.418 2.658 20 70 CFIDHN CS(=O)(=O)CCCCN1CCC[C@@H]1Cc1ccccc1 ZINC000161328348 541586160 /nfs/dbraw/zinc/58/61/60/541586160.db2.gz OHLMOPFLTSHXIW-MRXNPFEDSA-N 0 3 295.448 2.518 20 70 CFIDHN COc1ccc(CNC2(C)CCC2)c(OC)c1OC ZINC000159915322 378737662 /nfs/dbraw/zinc/73/76/62/378737662.db2.gz JLXJLNLIDLAQII-UHFFFAOYSA-N 0 3 265.353 2.745 20 70 CFIDHN C[C@H](NCCC(C)(C)O)c1cnn(Cc2ccccc2)c1 ZINC000159964025 378740824 /nfs/dbraw/zinc/74/08/24/378740824.db2.gz YARJVHOLDQKXJS-AWEZNQCLSA-N 0 3 287.407 2.743 20 70 CFIDHN C[C@H](NC[C@@](C)(O)c1ccsc1)c1cncs1 ZINC000159959528 378741063 /nfs/dbraw/zinc/74/10/63/378741063.db2.gz GJSJPTUFXCHILP-JOYOIKCWSA-N 0 3 268.407 2.763 20 70 CFIDHN CC[C@@H](NCCN(C)CCOC)c1ccc(F)cc1F ZINC000159376251 378705375 /nfs/dbraw/zinc/70/53/75/378705375.db2.gz IGAIOCUFQMCWHS-OAHLLOKOSA-N 0 3 286.366 2.584 20 70 CFIDHN CCN1CCCN(C(=O)NCc2ccc(C)cc2C)CC1 ZINC000159703273 378724577 /nfs/dbraw/zinc/72/45/77/378724577.db2.gz PUOGSGGPTBUTGE-UHFFFAOYSA-N 0 3 289.423 2.541 20 70 CFIDHN C[C@H](CN[C@@H](C)c1cnn(C)c1)N1CCc2ccccc2C1 ZINC000159809096 378731427 /nfs/dbraw/zinc/73/14/27/378731427.db2.gz DWCYNWDWOZWLKH-CABCVRRESA-N 0 3 298.434 2.518 20 70 CFIDHN CCC(=O)N1CC[C@@H](N[C@@H](C)c2ccccc2C)C1 ZINC000159819737 378731483 /nfs/dbraw/zinc/73/14/83/378731483.db2.gz QWZKGNDDNZEPHV-UONOGXRCSA-N 0 3 260.381 2.657 20 70 CFIDHN CCCOc1cccc(CN2CCC(CC(N)=O)CC2)c1 ZINC000159809001 378732725 /nfs/dbraw/zinc/73/27/25/378732725.db2.gz UFSUBCBWFVMKLJ-UHFFFAOYSA-N 0 3 290.407 2.563 20 70 CFIDHN COc1ccccc1CN1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160799406 378800186 /nfs/dbraw/zinc/80/01/86/378800186.db2.gz HIHSZJTXGMJFPO-NVXWUHKLSA-N 0 3 275.392 2.822 20 70 CFIDHN Cc1cccc([C@H](C)NCC(=O)NCC(F)(F)F)c1C ZINC000160536482 378778977 /nfs/dbraw/zinc/77/89/77/378778977.db2.gz KQEBZLZFXUCZBL-NSHDSACASA-N 0 3 288.313 2.633 20 70 CFIDHN CC[C@@H](COC)NCc1ccc(N2CCCCCC2)nc1 ZINC000160553024 378780816 /nfs/dbraw/zinc/78/08/16/378780816.db2.gz WQFUTHYAKOWEBG-INIZCTEOSA-N 0 3 291.439 2.977 20 70 CFIDHN O=C(CNCC1CC1)Nc1ccccc1CC(F)(F)F ZINC000160799769 378800747 /nfs/dbraw/zinc/80/07/47/378800747.db2.gz QQWSPYQXIFQQSU-UHFFFAOYSA-N 0 3 286.297 2.730 20 70 CFIDHN CCc1ccc([C@H](C)NCC(=O)NCC(F)(F)F)s1 ZINC000160619006 378786702 /nfs/dbraw/zinc/78/67/02/378786702.db2.gz FWPSDFRPEVOYEN-QMMMGPOBSA-N 0 3 294.342 2.640 20 70 CFIDHN COc1cc(OC)c([C@@H](C)NCC(C)(C)O)cc1Cl ZINC000160642686 378787979 /nfs/dbraw/zinc/78/79/79/378787979.db2.gz NOKIFWDSZIBCGF-SECBINFHSA-N 0 3 287.787 2.779 20 70 CFIDHN COc1cccc([C@@H](O)CN[C@@H](C)c2ccco2)c1 ZINC000160783581 378798475 /nfs/dbraw/zinc/79/84/75/378798475.db2.gz DUZDQQYBPNTQDK-FZMZJTMJSA-N 0 3 261.321 2.672 20 70 CFIDHN CS[C@@H](C)CC(=O)Nc1ccc(OCCN(C)C)cc1 ZINC000160219360 378758459 /nfs/dbraw/zinc/75/84/59/378758459.db2.gz OXFRDQXGYOEBRJ-LBPRGKRZSA-N 0 3 296.436 2.707 20 70 CFIDHN COC(CN1C[C@H](C)C[C@@H]1c1cccc(F)c1)OC ZINC000161271147 378834804 /nfs/dbraw/zinc/83/48/04/378834804.db2.gz LRHPOJPLFVQBHN-BXUZGUMPSA-N 0 3 267.344 2.828 20 70 CFIDHN C[C@@H](CN1CCCC1=O)NCc1cc(F)cc(Cl)c1 ZINC000160901736 378807955 /nfs/dbraw/zinc/80/79/55/378807955.db2.gz UNAAEJYTWBYYKD-JTQLQIEISA-N 0 3 284.762 2.580 20 70 CFIDHN Cc1ccc(CN[C@@H](C)c2ccc(-n3cnnn3)cc2)s1 ZINC000160944134 378811111 /nfs/dbraw/zinc/81/11/11/378811111.db2.gz DKCKBPNVMYYLKR-LBPRGKRZSA-N 0 3 299.403 2.883 20 70 CFIDHN C[C@@H](N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000160986347 378813518 /nfs/dbraw/zinc/81/35/18/378813518.db2.gz NBARJVOQTJUJBK-RNFRBKRXSA-N 0 3 261.152 2.518 20 70 CFIDHN CC(C)[C@H](N)C(=O)N[C@H](C)c1ccc(F)cc1Cl ZINC000161153014 378826565 /nfs/dbraw/zinc/82/65/65/378826565.db2.gz NBBBAEFBXKYTQF-PELKAZGASA-N 0 3 272.751 2.640 20 70 CFIDHN CCOC(=O)[C@H]1CC[C@H](NCc2ccco2)C[C@@H]1C ZINC000161481044 378851320 /nfs/dbraw/zinc/85/13/20/378851320.db2.gz SOFMJNFLZMULJW-OBJOEFQTSA-N 0 3 265.353 2.737 20 70 CFIDHN CC[C@H](N)C(=O)NCC(C)(C)CCCc1ccccc1 ZINC000160122390 322332915 /nfs/dbraw/zinc/33/29/15/322332915.db2.gz FEHSVFXRZHKOBB-HNNXBMFYSA-N 0 3 276.424 2.889 20 70 CFIDHN CSC[C@H](CCO)N[C@@H]1CCc2cc(F)ccc21 ZINC000160153710 286681562 /nfs/dbraw/zinc/68/15/62/286681562.db2.gz NUJQIVGMGSUYQN-GXTWGEPZSA-N 0 3 269.385 2.517 20 70 CFIDHN CCC[C@@]1(C)CCCN(C(=O)[C@@H](N)Cc2ccccc2)C1 ZINC000160932397 276036294 /nfs/dbraw/zinc/03/62/94/276036294.db2.gz KJINLIFFTIIGIT-WMZOPIPTSA-N 0 3 288.435 2.985 20 70 CFIDHN CC(C)c1ccc(N(C)C(=O)[C@@H]2CCCCN2)cc1 ZINC000161458702 276054177 /nfs/dbraw/zinc/05/41/77/276054177.db2.gz ANFUNKAAIZLLET-HNNXBMFYSA-N 0 3 260.381 2.915 20 70 CFIDHN CCCCN(C)CCNC(=O)N[C@H](CC)c1nccs1 ZINC000159812640 322328831 /nfs/dbraw/zinc/32/88/31/322328831.db2.gz WMCPLSLJUDPJNO-GFCCVEGCSA-N 0 3 298.456 2.625 20 70 CFIDHN CC(C)N(CCOC[C@H]1CCCO1)CCc1nccs1 ZINC000159943257 322330470 /nfs/dbraw/zinc/33/04/70/322330470.db2.gz OPGMKQKSGBGZEX-CQSZACIVSA-N 0 3 298.452 2.592 20 70 CFIDHN CCCC(=O)Nc1cccc(CN[C@@H](CC)COC)c1 ZINC000159934571 322330539 /nfs/dbraw/zinc/33/05/39/322330539.db2.gz WVMDTZBYGYQSLC-AWEZNQCLSA-N 0 3 278.396 2.940 20 70 CFIDHN CC[C@]1(C)C[C@H]1C(=O)N[C@@H](CN(C)C)c1ccccc1 ZINC000160204265 322334350 /nfs/dbraw/zinc/33/43/50/322334350.db2.gz DSYWEXQFVKQXJV-YQQAZPJKSA-N 0 3 274.408 2.842 20 70 CFIDHN Cc1cccc([C@H]2CCCN2CCOCC2CC2)n1 ZINC000160241152 322335093 /nfs/dbraw/zinc/33/50/93/322335093.db2.gz OODFEBGCQCCXIL-MRXNPFEDSA-N 0 3 260.381 2.954 20 70 CFIDHN C[C@@H](Cc1cccc(Cl)c1)C(=O)NC1CCN(C)CC1 ZINC000160245140 322335325 /nfs/dbraw/zinc/33/53/25/322335325.db2.gz YUEHCEXSBQVPBN-LBPRGKRZSA-N 0 3 294.826 2.729 20 70 CFIDHN CCCCCN1CCC([C@H](O)C(F)(F)F)CC1 ZINC000161197909 322348511 /nfs/dbraw/zinc/34/85/11/322348511.db2.gz RFPMZRSDKCWERQ-NSHDSACASA-N 0 3 253.308 2.812 20 70 CFIDHN CCCN(CCO)Cc1cccc(OC)c1OC(C)C ZINC000161222861 322349285 /nfs/dbraw/zinc/34/92/85/322349285.db2.gz VCZQCFALDMEGGK-UHFFFAOYSA-N 0 3 281.396 2.687 20 70 CFIDHN C[C@H](c1ccncc1)N(C)C(=O)c1ccc(CN(C)C)cc1 ZINC000161489447 322352577 /nfs/dbraw/zinc/35/25/77/322352577.db2.gz UWBYGHBJCOMFFS-CQSZACIVSA-N 0 3 297.402 2.976 20 70 CFIDHN CC(C)CC[C@@](C)(O)CN[C@@H](C)c1cncs1 ZINC000159365968 519687964 /nfs/dbraw/zinc/68/79/64/519687964.db2.gz MRGPMLHPNGRZGC-WCQYABFASA-N 0 3 256.415 2.981 20 70 CFIDHN CCOC[C@@H]1CCN(Cc2c(C)nc3ccccn32)C1 ZINC000160944214 520132447 /nfs/dbraw/zinc/13/24/47/520132447.db2.gz ULFULOXXCXYAFF-CQSZACIVSA-N 0 3 273.380 2.501 20 70 CFIDHN CCOC(=O)CCCN1CCC[C@H]1c1cccc(C)n1 ZINC000159842851 520640364 /nfs/dbraw/zinc/64/03/64/520640364.db2.gz SRJPWMWQYZRYGX-HNNXBMFYSA-N 0 3 276.380 2.870 20 70 CFIDHN CCOc1ccc([C@@H](C)N[C@H](CCO)CSC)cc1 ZINC000160404082 521226569 /nfs/dbraw/zinc/22/65/69/521226569.db2.gz GARFCEFOFIUSCH-TZMCWYRMSA-N 0 3 283.437 2.850 20 70 CFIDHN CCSCc1cccc(NC(=O)[C@H](N)CCSC)c1 ZINC000161481687 521718492 /nfs/dbraw/zinc/71/84/92/521718492.db2.gz QZUQZNFILAGNDM-CYBMUJFWSA-N 0 3 298.477 2.959 20 70 CFIDHN CCc1nc(CN2CCC[C@@H]2C(C)(C)CC)n[nH]1 ZINC000159450090 522305022 /nfs/dbraw/zinc/30/50/22/522305022.db2.gz QWHZNBZVZZIHDE-LLVKDONJSA-N 0 3 250.390 2.768 20 70 CFIDHN CCc1nc(CNC2(c3ccccc3)CCCC2)n[nH]1 ZINC000160434886 522341113 /nfs/dbraw/zinc/34/11/13/522341113.db2.gz ZMVYWANZZKQMGF-UHFFFAOYSA-N 0 3 270.380 2.926 20 70 CFIDHN CCc1nc(CN[C@H](c2ccccc2)C2CC2)n[nH]1 ZINC000160541312 522355414 /nfs/dbraw/zinc/35/54/14/522355414.db2.gz KJRUCSTVQQYGBP-OAHLLOKOSA-N 0 3 256.353 2.608 20 70 CFIDHN CC[C@@H](NC[C@H]1CN(C2CC2)CCO1)c1ccc(F)cc1 ZINC000160913238 522866493 /nfs/dbraw/zinc/86/64/93/522866493.db2.gz UUZPEEXCRLNKCW-DLBZAZTESA-N 0 3 292.398 2.730 20 70 CFIDHN COC(=O)CCN(CCC(=O)c1ccc(C)cc1)C(C)C ZINC000159664877 523066933 /nfs/dbraw/zinc/06/69/33/523066933.db2.gz IRQLSUPVHFTNKQ-UHFFFAOYSA-N 0 3 291.391 2.841 20 70 CFIDHN CN(C[C@H]1CCCN(C)C1)c1nc(C(C)(C)C)ns1 ZINC000159508516 523118254 /nfs/dbraw/zinc/11/82/54/523118254.db2.gz NAEJDMPQUQRPLH-NSHDSACASA-N 0 3 282.457 2.614 20 70 CFIDHN C[C@H](NCC1(CO)CCCC1)c1nc2ccccc2n1C ZINC000160096546 525318726 /nfs/dbraw/zinc/31/87/26/525318726.db2.gz WYUUXQOOIPGHRS-ZDUSSCGKSA-N 0 3 287.407 2.777 20 70 CFIDHN CSC[C@@H](CCO)N[C@H](C)c1ccc(F)cc1 ZINC000160356029 525643248 /nfs/dbraw/zinc/64/32/48/525643248.db2.gz ZWYXWWXPYOJYKD-ZWNOBZJWSA-N 0 3 257.374 2.590 20 70 CFIDHN NC(=O)c1cccc(CNCc2cccc3cc[nH]c32)c1 ZINC000218088372 527081921 /nfs/dbraw/zinc/08/19/21/527081921.db2.gz ZZBUFGYJAVNTAJ-UHFFFAOYSA-N 0 3 279.343 2.557 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H](C)CCCC(C)C)CC1 ZINC000159510738 529028938 /nfs/dbraw/zinc/02/89/38/529028938.db2.gz RGKITKSMTOIPRJ-OAHLLOKOSA-N 0 3 283.460 2.938 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cc(C)cc(C)c1)CC2 ZINC000160304478 282117591 /nfs/dbraw/zinc/11/75/91/282117591.db2.gz WAUHNLWUTJDOFP-BBRMVZONSA-N 0 3 284.407 2.869 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@H]1CCCc3sccc31)CC2 ZINC000160493506 282119350 /nfs/dbraw/zinc/11/93/50/282119350.db2.gz PUEWRNHZNFWYFO-AAEUAGOBSA-N 0 3 288.420 2.630 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc3c(c1)CCC3)CC2 ZINC000160383119 188468921 /nfs/dbraw/zinc/46/89/21/188468921.db2.gz YKLMBOJYXHFYOI-SJCJKPOMSA-N 0 3 296.418 2.741 20 70 CFIDHN Cc1nccc(NC(=O)NC[C@@H]2CCCN(C)C2)c1Cl ZINC000159483711 540995115 /nfs/dbraw/zinc/99/51/15/540995115.db2.gz LTNPGPJSWILLCG-NSHDSACASA-N 0 3 296.802 2.507 20 70 CFIDHN CC1(C)CCC(C(=O)N[C@@H]2CCN(CC3CC3)C2)CC1 ZINC000160144690 541022041 /nfs/dbraw/zinc/02/20/41/541022041.db2.gz QLOFLBOJCYMFMN-OAHLLOKOSA-N 0 3 278.440 2.803 20 70 CFIDHN CCCN(C)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000159904050 378737563 /nfs/dbraw/zinc/73/75/63/378737563.db2.gz CHERWLBMVPFNNH-GDBMZVCRSA-N 0 3 289.423 2.701 20 70 CFIDHN CCCCNC(=O)c1ccc(CN[C@@H](CC)COC)cc1 ZINC000160117338 378749706 /nfs/dbraw/zinc/74/97/06/378749706.db2.gz HIXFJBDTIDFUKI-INIZCTEOSA-N 0 3 292.423 2.731 20 70 CFIDHN CC[C@@H](C)N(C)CCN[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000160122295 378750783 /nfs/dbraw/zinc/75/07/83/378750783.db2.gz QBGTYKBDCBQRHM-LAPQFRIASA-N 0 3 296.480 2.805 20 70 CFIDHN Cc1ccc(C(=O)CCN2C[C@@H](C)N(C)[C@@H](C)C2)cc1 ZINC000160216446 378755165 /nfs/dbraw/zinc/75/51/65/378755165.db2.gz JFWKVZKUPNJWLK-GASCZTMLSA-N 0 3 274.408 2.592 20 70 CFIDHN CCCCOc1ccc([C@H](C)NCCO)cc1OC ZINC000159713398 378726505 /nfs/dbraw/zinc/72/65/05/378726505.db2.gz NHVQCXWQEYLUTE-LBPRGKRZSA-N 0 3 267.369 2.517 20 70 CFIDHN CCCOc1ccc([C@@H](C)NCCO)c(OCCC)c1 ZINC000159705092 378726689 /nfs/dbraw/zinc/72/66/89/378726689.db2.gz SNZSCEMLDAPUME-CYBMUJFWSA-N 0 3 281.396 2.907 20 70 CFIDHN C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)[C@@H](N)C(C)(C)C ZINC000159803221 378730619 /nfs/dbraw/zinc/73/06/19/378730619.db2.gz FRONBGOBJUXJHC-NJZAAPMLSA-N 0 3 292.398 2.904 20 70 CFIDHN CC(C)N(C)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160380178 378766789 /nfs/dbraw/zinc/76/67/89/378766789.db2.gz XCBZKZPTLOSQNC-ZBFHGGJFSA-N 0 3 289.423 2.699 20 70 CFIDHN CCc1ccc(/C=C/C(=O)N(C)[C@@H]2CCN(C)C[C@@H]2C)o1 ZINC000160416071 378770234 /nfs/dbraw/zinc/77/02/34/378770234.db2.gz MFDMYBCGJZEBNH-FTJFNGAWSA-N 0 3 290.407 2.654 20 70 CFIDHN CC[C@@H](COC)NCc1ccc(N2CCC(C)CC2)nc1 ZINC000160508991 378777220 /nfs/dbraw/zinc/77/72/20/378777220.db2.gz HJDFWSRSIQSJCF-INIZCTEOSA-N 0 3 291.439 2.833 20 70 CFIDHN CC(C)COCCN[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000160704009 378792809 /nfs/dbraw/zinc/79/28/09/378792809.db2.gz ARKIENYFKGLQCJ-ORAYPTAESA-N 0 3 283.437 2.747 20 70 CFIDHN CC(C)COCCN[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000160704248 378793330 /nfs/dbraw/zinc/79/33/30/378793330.db2.gz ARKIENYFKGLQCJ-DJJJIMSYSA-N 0 3 283.437 2.747 20 70 CFIDHN CC[C@@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(F)cc1F ZINC000161201364 378829898 /nfs/dbraw/zinc/82/98/98/378829898.db2.gz NEAPDGIMRFDDCU-BXUZGUMPSA-N 0 3 282.334 2.626 20 70 CFIDHN CCN1CCCC[C@H]1CN[C@@H](C)c1cncc(F)c1 ZINC000161198390 378829919 /nfs/dbraw/zinc/82/99/19/378829919.db2.gz SGNFBQJMBGTROH-WFASDCNBSA-N 0 3 265.376 2.746 20 70 CFIDHN CC(C)C[C@@H](NCC(=O)NC(C)C)c1cccs1 ZINC000160973310 378813621 /nfs/dbraw/zinc/81/36/21/378813621.db2.gz IMXCRRSMSOBNDY-GFCCVEGCSA-N 0 3 268.426 2.950 20 70 CFIDHN COc1cc(CNC(C)(C)[C@@H](C)O)ccc1OC(C)C ZINC000161135312 378824356 /nfs/dbraw/zinc/82/43/56/378824356.db2.gz FXZZPJRKKTVMGZ-GFCCVEGCSA-N 0 3 281.396 2.731 20 70 CFIDHN CC(C)[C@H](N)C(=O)N[C@@H](C)c1ccc(F)cc1Cl ZINC000161152886 378826379 /nfs/dbraw/zinc/82/63/79/378826379.db2.gz NBBBAEFBXKYTQF-UFBFGSQYSA-N 0 3 272.751 2.640 20 70 CFIDHN COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)[C@H](C)N ZINC000161415324 378844547 /nfs/dbraw/zinc/84/45/47/378844547.db2.gz NYBZDQCZHCIBOV-GXFFZTMASA-N 0 3 298.814 2.899 20 70 CFIDHN C[C@@H]1CCC[C@H](N[C@@H](C(N)=O)c2ccccc2)[C@@H]1C ZINC000217774265 382787983 /nfs/dbraw/zinc/78/79/83/382787983.db2.gz HECZMCPGRURAFJ-RJZRQDKASA-N 0 3 260.381 2.627 20 70 CFIDHN CCCn1c2ccccc2nc1CNC[C@H]1CCCN1C ZINC000218235372 382789829 /nfs/dbraw/zinc/78/98/29/382789829.db2.gz PWSPERSCDBWUKM-CQSZACIVSA-N 0 3 286.423 2.630 20 70 CFIDHN CO[C@]1(C)C[C@@H](NCc2ccccc2NC(C)=O)C1(C)C ZINC000160511647 394366500 /nfs/dbraw/zinc/36/65/00/394366500.db2.gz CODOOPPEMDYLKN-NVXWUHKLSA-N 0 3 290.407 2.938 20 70 CFIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1nccs1 ZINC000160518937 394366626 /nfs/dbraw/zinc/36/66/26/394366626.db2.gz IPZYVIFFPYWYGZ-QWRGUYRKSA-N 0 3 269.414 2.838 20 70 CFIDHN CC(C)(O)CN[C@H]1CCCOc2ccc(Cl)cc21 ZINC000160591571 394366906 /nfs/dbraw/zinc/36/69/06/394366906.db2.gz QPJHITUNZSAHRV-LBPRGKRZSA-N 0 3 269.772 2.914 20 70 CFIDHN Cc1cccc([C@@H]2CCCCCN2C(=O)[C@H](C)N)c1 ZINC000160983381 302022781 /nfs/dbraw/zinc/02/27/81/302022781.db2.gz SMCCYTNIFZPSIR-ZFWWWQNUSA-N 0 3 260.381 2.786 20 70 CFIDHN CC[C@H](c1ccc(Cl)cc1)N(C)CC(C)(CO)CO ZINC000159575366 322324636 /nfs/dbraw/zinc/32/46/36/322324636.db2.gz MEUDHODBVZFVHM-CQSZACIVSA-N 0 3 285.815 2.714 20 70 CFIDHN C[C@@H](NCCCc1cccc(F)c1)c1cnccn1 ZINC000159768187 322328097 /nfs/dbraw/zinc/32/80/97/322328097.db2.gz VNMFWTFIWHOADY-GFCCVEGCSA-N 0 3 259.328 2.899 20 70 CFIDHN CCCCC[C@H](C)NC(=O)N1CCCN(CC)CC1 ZINC000159512639 520302717 /nfs/dbraw/zinc/30/27/17/520302717.db2.gz GWJUHVBWXRJAEY-AWEZNQCLSA-N 0 3 269.433 2.692 20 70 CFIDHN CC(=O)Nc1cccc([C@H](C)NCC2(CO)CCCC2)c1 ZINC000160102436 519748399 /nfs/dbraw/zinc/74/83/99/519748399.db2.gz VLRVQOAQWUIAOP-ZDUSSCGKSA-N 0 3 290.407 2.848 20 70 CFIDHN CCCN1CCCN(C(=O)NCc2ccc(C)cc2)CC1 ZINC000160013907 519850041 /nfs/dbraw/zinc/85/00/41/519850041.db2.gz NUQSBPBOQFLVSK-UHFFFAOYSA-N 0 3 289.423 2.622 20 70 CFIDHN CCN(C)CCNc1ncc(Cl)cc1Br ZINC000159589632 520240342 /nfs/dbraw/zinc/24/03/42/520240342.db2.gz GTUFYVGFCWZDFX-UHFFFAOYSA-N 0 3 292.608 2.861 20 70 CFIDHN CCCCS[C@@H](C)C(=O)N1CCCN(CCC)CC1 ZINC000160369395 520959436 /nfs/dbraw/zinc/95/94/36/520959436.db2.gz VVCZCYNYDWKOIH-AWEZNQCLSA-N 0 3 286.485 2.853 20 70 CFIDHN CCN(CCNCc1cccc2c1OC(C)(C)C2)C1CC1 ZINC000217797987 521078150 /nfs/dbraw/zinc/07/81/50/521078150.db2.gz NHXCMOSNDCWMJE-UHFFFAOYSA-N 0 3 288.435 2.974 20 70 CFIDHN CC[C@H](C)c1cc(C(=O)NC2CCN(C3CC3)CC2)on1 ZINC000159373270 522027884 /nfs/dbraw/zinc/02/78/84/522027884.db2.gz TYQWWLUNESIZDP-NSHDSACASA-N 0 3 291.395 2.545 20 70 CFIDHN CC[C@H](C)c1cc(C(=O)N[C@H](C)CN2CCCCC2)on1 ZINC000160369836 522032420 /nfs/dbraw/zinc/03/24/20/522032420.db2.gz GHLZMJUQDYYTEH-QWHCGFSZSA-N 0 3 293.411 2.792 20 70 CFIDHN CCc1nnc(C[NH2+][C@@H]2C[C@@H](C)CC[C@@H]2C(C)C)[n-]1 ZINC000160545614 522350939 /nfs/dbraw/zinc/35/09/39/522350939.db2.gz MSMQTEBSCDJIQB-YNEHKIRRSA-N 0 3 264.417 2.918 20 70 CFIDHN CC[C@H](NC[C@@H]1CN(C2CC2)CCO1)c1ccc(F)cc1 ZINC000160912848 522621911 /nfs/dbraw/zinc/62/19/11/522621911.db2.gz UUZPEEXCRLNKCW-SJORKVTESA-N 0 3 292.398 2.730 20 70 CFIDHN CCn1cc([C@@H](C)NC[C@](C)(O)CCC(C)C)cn1 ZINC000159392010 523455110 /nfs/dbraw/zinc/45/51/10/523455110.db2.gz ZLHJWMYZNFIFFC-UKRRQHHQSA-N 0 3 267.417 2.741 20 70 CFIDHN CSCCCCC(=O)N[C@H](C)CN1CCCCC1 ZINC000159755864 525406428 /nfs/dbraw/zinc/40/64/28/525406428.db2.gz BKMVGXFXTDCXCW-CYBMUJFWSA-N 0 3 272.458 2.510 20 70 CFIDHN CSC[C@H](CCO)N[C@@H](CC(C)C)c1ccccn1 ZINC000160174390 525698494 /nfs/dbraw/zinc/69/84/94/525698494.db2.gz FNIWMZPUYDTAGX-ZFWWWQNUSA-N 0 3 282.453 2.872 20 70 CFIDHN CCN1CCCN(C(=O)NCC(C)(C)CC(C)C)CC1 ZINC000159958280 529023951 /nfs/dbraw/zinc/02/39/51/529023951.db2.gz UXYPCEWLVMDIJI-UHFFFAOYSA-N 0 3 283.460 2.796 20 70 CFIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)NC1CCCCC1 ZINC000159664880 348014521 /nfs/dbraw/zinc/01/45/21/348014521.db2.gz RQZJLMRWKKDZAN-ZFWWWQNUSA-N 0 3 264.413 2.700 20 70 CFIDHN CC[C@@H]1CCCN(C(=O)N[C@@H]2CCN(CC3CC3)C2)CC1 ZINC000160700395 348019780 /nfs/dbraw/zinc/01/97/80/348019780.db2.gz FYCDSGMEWXESFY-GDBMZVCRSA-N 0 3 293.455 2.692 20 70 CFIDHN Cc1cccc2c1CCN2C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000160755691 348020718 /nfs/dbraw/zinc/02/07/18/348020718.db2.gz YYZYVCKCUJYBRA-HNNXBMFYSA-N 0 3 299.418 2.551 20 70 CFIDHN CCNC(=O)CNCC(c1ccccc1)c1ccccc1 ZINC000218590619 348167458 /nfs/dbraw/zinc/16/74/58/348167458.db2.gz RUULBQZVNDSPPT-UHFFFAOYSA-N 0 3 282.387 2.544 20 70 CFIDHN CCCn1nccc1CNc1cccc(CN(C)C)c1 ZINC000160027999 540667571 /nfs/dbraw/zinc/66/75/71/540667571.db2.gz YVTITIYYCDBUGF-UHFFFAOYSA-N 0 3 272.396 2.967 20 70 CFIDHN CC(C)C(=O)NCCCN[C@H]1CCc2c1cc(F)cc2F ZINC000159976679 541019499 /nfs/dbraw/zinc/01/94/99/541019499.db2.gz PAMKMRNTROHUNC-HNNXBMFYSA-N 0 3 296.361 2.704 20 70 CFIDHN Cc1ccc(CN[C@H](C)c2ccc(-n3cncn3)cc2)cn1 ZINC000161322600 541585555 /nfs/dbraw/zinc/58/55/55/541585555.db2.gz IBXBOMDEMPDMIS-CQSZACIVSA-N 0 3 293.374 2.822 20 70 CFIDHN C[C@H](c1ccccc1)N1CCN(c2ccncc2)CC1 ZINC000161353436 541601009 /nfs/dbraw/zinc/60/10/09/541601009.db2.gz JZYBEMTTZPUUAC-OAHLLOKOSA-N 0 3 267.376 2.965 20 70 CFIDHN Oc1ccc(CN[C@@H]2CCc3c2cccc3O)cc1 ZINC000161479798 541651258 /nfs/dbraw/zinc/65/12/58/541651258.db2.gz XVQUCBDKXZOJRM-OAHLLOKOSA-N 0 3 255.317 2.875 20 70 CFIDHN CN(C)Cc1ccc(C(=O)NCCC2=CCCC2)cc1 ZINC000160148598 378752078 /nfs/dbraw/zinc/75/20/78/378752078.db2.gz BTWHJSOXCPTWFK-UHFFFAOYSA-N 0 3 272.392 2.978 20 70 CFIDHN Cc1ccnc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000160214199 378755573 /nfs/dbraw/zinc/75/55/73/378755573.db2.gz MPAMMBBKWXKWHK-BBRMVZONSA-N 0 3 282.391 2.717 20 70 CFIDHN Cn1c(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)nc2ccccc21 ZINC000159571457 378717647 /nfs/dbraw/zinc/71/76/47/378717647.db2.gz UETVFZYZLOFARS-JLZZUVOBSA-N 0 3 297.402 2.621 20 70 CFIDHN CCc1ccc([C@H](C)NCCCN2CCCC2=O)o1 ZINC000159587430 378719067 /nfs/dbraw/zinc/71/90/67/378719067.db2.gz NMGNSPUYPCWVDZ-LBPRGKRZSA-N 0 3 264.369 2.505 20 70 CFIDHN CCN1CCCN(C(=O)N[C@@H](C)c2ccc(C)cc2)CC1 ZINC000159707012 378725973 /nfs/dbraw/zinc/72/59/73/378725973.db2.gz RBWBVTCWQKTFDY-HNNXBMFYSA-N 0 3 289.423 2.793 20 70 CFIDHN CSCC[C@H](N)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000159716842 378726147 /nfs/dbraw/zinc/72/61/47/378726147.db2.gz LDNIMBRCQPPYDU-SOUVJXGZSA-N 0 3 292.448 2.519 20 70 CFIDHN NC(=O)CC1CCN(Cc2cc3ccccc3s2)CC1 ZINC000159746401 378728036 /nfs/dbraw/zinc/72/80/36/378728036.db2.gz SBTAAIOEPMLPDJ-UHFFFAOYSA-N 0 3 288.416 2.989 20 70 CFIDHN CNCC(=O)N1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 ZINC000159780924 378730574 /nfs/dbraw/zinc/73/05/74/378730574.db2.gz HSQZOOOXOMQNBE-XJKSGUPXSA-N 0 3 260.381 2.514 20 70 CFIDHN CCc1nc(CN[C@@H](CC)c2ccc(C)cc2)n[nH]1 ZINC000160273136 378760501 /nfs/dbraw/zinc/76/05/01/378760501.db2.gz GUFXVBSXGLHYFB-ZDUSSCGKSA-N 0 3 258.369 2.916 20 70 CFIDHN C[C@@H](CNc1nnc(C(F)(F)F)s1)CN1CCCC1 ZINC000160331893 378764127 /nfs/dbraw/zinc/76/41/27/378764127.db2.gz SORFAZIEQAHALE-QMMMGPOBSA-N 0 3 294.346 2.701 20 70 CFIDHN C[C@@H]1C[C@H](NC(=O)NC(C)(C)C)CN1Cc1ccccc1 ZINC000160380630 378768625 /nfs/dbraw/zinc/76/86/25/378768625.db2.gz LEHPUYOQHDYEJS-HIFRSBDPSA-N 0 3 289.423 2.747 20 70 CFIDHN CC(=O)Nc1ccccc1CNC[C@@H](O)c1ccsc1 ZINC000160474821 378776073 /nfs/dbraw/zinc/77/60/73/378776073.db2.gz OMLHNSZZJPBZFV-OAHLLOKOSA-N 0 3 290.388 2.530 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cc3ccccc3o1)CC2 ZINC000160551017 378780085 /nfs/dbraw/zinc/78/00/85/378780085.db2.gz RCLIFPCFYGOKSR-SMDDNHRTSA-N 0 3 296.374 2.998 20 70 CFIDHN CCCN(CCO)Cc1cnn(-c2ccc(Cl)cc2)c1 ZINC000161201203 378829942 /nfs/dbraw/zinc/82/99/42/378829942.db2.gz AMUIJBNQKGLIHV-UHFFFAOYSA-N 0 3 293.798 2.730 20 70 CFIDHN CC(C)C1(CNC(=O)[C@H](C)[C@H](N)c2ccccc2)CC1 ZINC000160818760 378801894 /nfs/dbraw/zinc/80/18/94/378801894.db2.gz DYXCPGKMKJBJPT-HIFRSBDPSA-N 0 3 274.408 2.875 20 70 CFIDHN C[C@@H](NC[C@H](C)N(C)Cc1ccccc1)c1cnccn1 ZINC000160864246 378804577 /nfs/dbraw/zinc/80/45/77/378804577.db2.gz IPVRAQYKWIQQGC-LSDHHAIUSA-N 0 3 284.407 2.648 20 70 CFIDHN CSCC[C@H](N)C(=O)NCCCCC1CCCC1 ZINC000160901207 378808032 /nfs/dbraw/zinc/80/80/32/378808032.db2.gz KZRBUUXBCYZYNQ-ZDUSSCGKSA-N 0 3 272.458 2.544 20 70 CFIDHN CC(C)c1cnc(NC(=O)[C@@H](N)C(C)(C)C)s1 ZINC000160894558 378808476 /nfs/dbraw/zinc/80/84/76/378808476.db2.gz PRHOQOQHRBXEMV-SECBINFHSA-N 0 3 255.387 2.578 20 70 CFIDHN COC(C)(C)C[C@H](C)NC(=O)[C@@H](C)[C@H](N)c1ccccc1 ZINC000160966358 378811201 /nfs/dbraw/zinc/81/12/01/378811201.db2.gz KPFSLHDREJERLQ-YDHLFZDLSA-N 0 3 292.423 2.642 20 70 CFIDHN COC(CN(C)CC(C)(C)c1ccc(C)cc1)OC ZINC000161275301 378835259 /nfs/dbraw/zinc/83/52/59/378835259.db2.gz UZQVGYLIJJKPGW-UHFFFAOYSA-N 0 3 265.397 2.823 20 70 CFIDHN CC(=O)NC1CCC(N[C@H](C)c2nc(C)cs2)CC1 ZINC000161415239 378844610 /nfs/dbraw/zinc/84/46/10/378844610.db2.gz QONPEMAMIBSRPY-QFWMXSHPSA-N 0 3 281.425 2.549 20 70 CFIDHN Cc1ccccc1[C@@H](C)NCCOC[C@H]1CCCO1 ZINC000159644270 322325545 /nfs/dbraw/zinc/32/55/45/322325545.db2.gz UEGGNUXHICDCSL-HUUCEWRRSA-N 0 3 263.381 2.841 20 70 CFIDHN CC(C)[C@@H](CNCc1ccn(C)n1)c1ccccc1 ZINC000218093972 382789587 /nfs/dbraw/zinc/78/95/87/382789587.db2.gz OYMYPXOTZLGYPK-MRXNPFEDSA-N 0 3 257.381 2.950 20 70 CFIDHN CC[C@H]1CCCC[C@H]1NC(=O)N1CCCN(CC)CC1 ZINC000159684143 394365593 /nfs/dbraw/zinc/36/55/93/394365593.db2.gz AZYBOBZZGIEEOF-LSDHHAIUSA-N 0 3 281.444 2.692 20 70 CFIDHN Cc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)s1 ZINC000160303113 394366487 /nfs/dbraw/zinc/36/64/87/394366487.db2.gz TWNOGJYLIZFOQH-CMPLNLGQSA-N 0 3 276.409 2.622 20 70 CFIDHN CC(C)[C@H](C(=O)N[C@H]1CCCc2sccc21)N(C)C ZINC000160265245 273552029 /nfs/dbraw/zinc/55/20/29/273552029.db2.gz LEVGHOCHFRXUQY-GXTWGEPZSA-N 0 3 280.437 2.828 20 70 CFIDHN CC(C)N1CC[C@@H](N[C@H]2CCCc3cc(F)ccc32)C1=O ZINC000159543789 275642461 /nfs/dbraw/zinc/64/24/61/275642461.db2.gz XUNMKYKPQAKHTN-JKSUJKDBSA-N 0 3 290.382 2.802 20 70 CFIDHN C[C@H]1C[C@H](NCCc2ncn(C)n2)c2ccsc2S1 ZINC000217003351 280010595 /nfs/dbraw/zinc/01/05/95/280010595.db2.gz IXDMWHYLHLLUHK-ONGXEEELSA-N 0 3 294.449 2.634 20 70 CFIDHN COc1ccc2c(c1)[C@@H](N[C@@H](C)[C@@H]1CCCO1)CCO2 ZINC000217966533 280931727 /nfs/dbraw/zinc/93/17/27/280931727.db2.gz LPEBRBWGYRPVPL-CQDKDKBSSA-N 0 3 277.364 2.676 20 70 CFIDHN CCC[C@@H](N[C@@H]1CCN(C(=O)CC)C1)c1ccccn1 ZINC000159384982 322322490 /nfs/dbraw/zinc/32/24/90/322322490.db2.gz LWUQCZVCZLYPCA-UKRRQHHQSA-N 0 3 275.396 2.523 20 70 CFIDHN CCSCCN1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000159514337 322323528 /nfs/dbraw/zinc/32/35/28/322323528.db2.gz DUFWIKRYCSADJJ-GFCCVEGCSA-N 0 3 288.457 2.729 20 70 CFIDHN CCOc1ccccc1[C@H](C)NCCCN1CCCC1=O ZINC000159564498 322324759 /nfs/dbraw/zinc/32/47/59/322324759.db2.gz RUONYFWEBDDSCM-AWEZNQCLSA-N 0 3 290.407 2.748 20 70 CFIDHN COc1ccc(NC(=O)CN2CC[C@@H]3CCCC[C@@H]32)cc1 ZINC000159677674 322326111 /nfs/dbraw/zinc/32/61/11/322326111.db2.gz PEBNFZUCOJQRPS-BBRMVZONSA-N 0 3 288.391 2.898 20 70 CFIDHN Cc1cnc([C@@H](NCCC(C)(C)O)C2CC2)s1 ZINC000159703902 322326903 /nfs/dbraw/zinc/32/69/03/322326903.db2.gz MOTGSRVODBYYTN-NSHDSACASA-N 0 3 254.399 2.653 20 70 CFIDHN C[C@H](NCCCc1cccc(F)c1)c1cnccn1 ZINC000159768061 322328067 /nfs/dbraw/zinc/32/80/67/322328067.db2.gz VNMFWTFIWHOADY-LBPRGKRZSA-N 0 3 259.328 2.899 20 70 CFIDHN Cc1nn(C)c(C)c1CN(CCc1nccs1)C(C)C ZINC000159860193 322329301 /nfs/dbraw/zinc/32/93/01/322329301.db2.gz NIKMQRVQTSBTOL-UHFFFAOYSA-N 0 3 292.452 2.947 20 70 CFIDHN CCN1CCCN(C(=O)NCCCC(C)(C)C)CC1 ZINC000159891809 322329876 /nfs/dbraw/zinc/32/98/76/322329876.db2.gz ZMWIIADFXNPYNZ-UHFFFAOYSA-N 0 3 269.433 2.550 20 70 CFIDHN CC(C)c1ccc(CC2CCN([C@@H](C)C(N)=O)CC2)cc1 ZINC000159950332 322331114 /nfs/dbraw/zinc/33/11/14/322331114.db2.gz LYXNLDHCOJLDIC-AWEZNQCLSA-N 0 3 288.435 2.938 20 70 CFIDHN CCCCSCCC(=O)NCCN1CCC[C@@H](C)C1 ZINC000159900811 520950573 /nfs/dbraw/zinc/95/05/73/520950573.db2.gz XGSOTPATMHBLMV-CQSZACIVSA-N 0 3 286.485 2.758 20 70 CFIDHN CC(C)(C)[C@H](N)C(=O)NCc1ccccc1OC1CCC1 ZINC000159709803 518961418 /nfs/dbraw/zinc/96/14/18/518961418.db2.gz IQYSYGPCFNGDHZ-OAHLLOKOSA-N 0 3 290.407 2.608 20 70 CFIDHN CC1(O)CCN(Cc2ccc(F)c3cccnc23)CC1 ZINC000161227661 520773997 /nfs/dbraw/zinc/77/39/97/520773997.db2.gz WWVYLFKEJNJBOQ-UHFFFAOYSA-N 0 3 274.339 2.721 20 70 CFIDHN CCOc1ccccc1[C@H](C)N[C@@H](CCO)CSC ZINC000160366717 521583601 /nfs/dbraw/zinc/58/36/01/521583601.db2.gz FFVQXURSKBJFTF-STQMWFEESA-N 0 3 283.437 2.850 20 70 CFIDHN CCc1nnc(C[NH2+][C@@H]2C[C@H](C)CC[C@@H]2C(C)C)[n-]1 ZINC000160545343 522351770 /nfs/dbraw/zinc/35/17/70/522351770.db2.gz MSMQTEBSCDJIQB-JHJVBQTASA-N 0 3 264.417 2.918 20 70 CFIDHN CC[C@@H](N[C@H](CCO)CSC)c1ccccc1OC ZINC000160375517 522943208 /nfs/dbraw/zinc/94/32/08/522943208.db2.gz JRBRVYYUXKVODF-TZMCWYRMSA-N 0 3 283.437 2.850 20 70 CFIDHN CCn1cc([C@@H](C)NC[C@@](C)(O)CCC(C)C)cn1 ZINC000159392299 523456934 /nfs/dbraw/zinc/45/69/34/523456934.db2.gz ZLHJWMYZNFIFFC-HIFRSBDPSA-N 0 3 267.417 2.741 20 70 CFIDHN C[C@H]1CN(Cc2ccc(C(F)(F)F)cc2)CC[C@@H]1O ZINC000159425886 524618010 /nfs/dbraw/zinc/61/80/10/524618010.db2.gz KRGUFMNNFMHFHE-GWCFXTLKSA-N 0 3 273.298 2.908 20 70 CFIDHN C[C@H](O)C(C)(C)NCc1ccccc1Br ZINC000160626805 525695873 /nfs/dbraw/zinc/69/58/73/525695873.db2.gz YTRMSXJCQKVWDT-VIFPVBQESA-N 0 3 272.186 2.698 20 70 CFIDHN Cc1ccc(C(=O)CCN(C[C@H](C)O)C(C)C)cc1 ZINC000159548374 526042947 /nfs/dbraw/zinc/04/29/47/526042947.db2.gz HQPJXLZJSPBLFD-AWEZNQCLSA-N 0 3 263.381 2.659 20 70 CFIDHN CC1CCN(CC(=O)NCCc2cc3ccccc3[nH]2)CC1 ZINC000159533333 528229923 /nfs/dbraw/zinc/22/99/23/528229923.db2.gz CUZNXVXNEYVPJV-UHFFFAOYSA-N 0 3 299.418 2.559 20 70 CFIDHN CCN1CCCN(C(=O)NCC2CCC(C)CC2)CC1 ZINC000159742235 529022550 /nfs/dbraw/zinc/02/25/50/529022550.db2.gz NINGSRPNWITZAH-UHFFFAOYSA-N 0 3 281.444 2.550 20 70 CFIDHN Cc1ccc(Cl)c(OC[C@H](O)CN2CCCCC2)c1 ZINC000159508853 232244400 /nfs/dbraw/zinc/24/44/00/232244400.db2.gz TVZAGAADBABGFQ-CYBMUJFWSA-N 0 3 283.799 2.874 20 70 CFIDHN O=c1cc(CN2CC[C@@H]3CCCC[C@@H]32)nc2sccn21 ZINC000159648881 348013604 /nfs/dbraw/zinc/01/36/04/348013604.db2.gz HURNYOZONUTUCT-AAEUAGOBSA-N 0 3 289.404 2.521 20 70 CFIDHN CC(C)CN(CC(C)C)C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000160636769 348019850 /nfs/dbraw/zinc/01/98/50/348019850.db2.gz WMUWBVWHCNWJMN-INIZCTEOSA-N 0 3 295.471 2.794 20 70 CFIDHN CCCn1nccc1CNCCc1cccc(F)c1 ZINC000160002687 540666766 /nfs/dbraw/zinc/66/67/66/540666766.db2.gz CPBDWAYAXQCMLZ-UHFFFAOYSA-N 0 3 261.344 2.765 20 70 CFIDHN CCCn1nccc1CNCCc1ccccc1C ZINC000160175155 540669697 /nfs/dbraw/zinc/66/96/97/540669697.db2.gz SXVMORQVMTWZEL-UHFFFAOYSA-N 0 3 257.381 2.934 20 70 CFIDHN CS(=O)(=O)CCCCN(Cc1ccco1)C1CCCC1 ZINC000161492442 541660219 /nfs/dbraw/zinc/66/02/19/541660219.db2.gz OSNCQWPMXDLSMK-UHFFFAOYSA-N 0 3 299.436 2.849 20 70 CFIDHN CCN1CCC[C@H]1CNC(=O)[C@@H]1C[C@@H]1c1sccc1C ZINC000159907956 378737341 /nfs/dbraw/zinc/73/73/41/378737341.db2.gz IULSHZLAZQHTBV-MELADBBJSA-N 0 3 292.448 2.761 20 70 CFIDHN CC1(C)C[C@H](NCc2ccn(-c3ccccc3)n2)CCO1 ZINC000159993315 378741465 /nfs/dbraw/zinc/74/14/65/378741465.db2.gz XJEZQBJFYQTYAN-CQSZACIVSA-N 0 3 285.391 2.920 20 70 CFIDHN Cc1ccc(C(=O)CCN(C)C[C@@H]2CCOC2)cc1 ZINC000160026299 378743756 /nfs/dbraw/zinc/74/37/56/378743756.db2.gz BRGLELLQJAPUCA-AWEZNQCLSA-N 0 3 261.365 2.536 20 70 CFIDHN C[C@H]1CCC[C@H](C(=O)NCCN2CCCCCC2)C1 ZINC000160222084 378757527 /nfs/dbraw/zinc/75/75/27/378757527.db2.gz XOLCUAVEMPATRO-GJZGRUSLSA-N 0 3 266.429 2.805 20 70 CFIDHN CC[C@@H](C(=O)N[C@H]1CCSc2c(F)cccc21)N(C)C ZINC000160097544 378748741 /nfs/dbraw/zinc/74/87/41/378748741.db2.gz ABBFACKOQWJTPW-STQMWFEESA-N 0 3 296.411 2.819 20 70 CFIDHN Cn1c(CN[C@H]2[C@H]3CCO[C@@H]3C23CCC3)nc2ccccc21 ZINC000159571609 378717780 /nfs/dbraw/zinc/71/77/80/378717780.db2.gz UETVFZYZLOFARS-DQYPLSBCSA-N 0 3 297.402 2.621 20 70 CFIDHN CNCC(=O)Nc1cccc(Cl)c1SCC(F)F ZINC000159589464 378718430 /nfs/dbraw/zinc/71/84/30/378718430.db2.gz BICGQEIMZQRZPI-UHFFFAOYSA-N 0 3 294.754 2.855 20 70 CFIDHN COc1cc(CN(C)CCOCC2CC2)cc(OC)c1 ZINC000159600315 378718822 /nfs/dbraw/zinc/71/88/22/378718822.db2.gz FKRGVYVXZDBLNB-UHFFFAOYSA-N 0 3 279.380 2.562 20 70 CFIDHN CCc1ccc([C@@H](C)NCCCN2CCCC2=O)o1 ZINC000159587312 378718852 /nfs/dbraw/zinc/71/88/52/378718852.db2.gz NMGNSPUYPCWVDZ-GFCCVEGCSA-N 0 3 264.369 2.505 20 70 CFIDHN C[C@H](NC1CCN(C(=O)c2ccoc2)CC1)c1ccco1 ZINC000160198694 378756021 /nfs/dbraw/zinc/75/60/21/378756021.db2.gz JUNQQDFPKUFGIV-LBPRGKRZSA-N 0 3 288.347 2.828 20 70 CFIDHN Clc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cn1 ZINC000159649124 378723061 /nfs/dbraw/zinc/72/30/61/378723061.db2.gz XNIGWSPBNSIARK-YUTCNCBUSA-N 0 3 278.783 2.782 20 70 CFIDHN CCC[C@H](N)C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000159811668 378732497 /nfs/dbraw/zinc/73/24/97/378732497.db2.gz HZOMLMNITPCLER-OCCSQVGLSA-N 0 3 280.799 2.783 20 70 CFIDHN C[C@H]1C[C@@H](NC(=O)NC(C)(C)C)CN1Cc1ccccc1 ZINC000160381041 378768402 /nfs/dbraw/zinc/76/84/02/378768402.db2.gz LEHPUYOQHDYEJS-DZGCQCFKSA-N 0 3 289.423 2.747 20 70 CFIDHN CC(C)N(C)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160380492 378768996 /nfs/dbraw/zinc/76/89/96/378768996.db2.gz XCBZKZPTLOSQNC-GOEBONIOSA-N 0 3 289.423 2.699 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(C)c(C)c1)CC2 ZINC000160414470 378770516 /nfs/dbraw/zinc/77/05/16/378770516.db2.gz XURVSWYOEZYOHA-BBRMVZONSA-N 0 3 284.407 2.869 20 70 CFIDHN CC[C@H](COC)NCc1ccc(N2CCC(C)CC2)nc1 ZINC000160509102 378777450 /nfs/dbraw/zinc/77/74/50/378777450.db2.gz HJDFWSRSIQSJCF-MRXNPFEDSA-N 0 3 291.439 2.833 20 70 CFIDHN Cc1ccc(OCCCN2CCC(C)(O)CC2)cc1C ZINC000161207275 378831005 /nfs/dbraw/zinc/83/10/05/378831005.db2.gz VFUWDPIMNBUXLC-UHFFFAOYSA-N 0 3 277.408 2.919 20 70 CFIDHN Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)[C@H](C)N)cc1 ZINC000161233827 378832169 /nfs/dbraw/zinc/83/21/69/378832169.db2.gz AURGJYPCEQUJAM-IPYPFGDCSA-N 0 3 260.381 2.642 20 70 CFIDHN Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)[C@@H](C)N)cc1 ZINC000161235111 378832295 /nfs/dbraw/zinc/83/22/95/378832295.db2.gz AURGJYPCEQUJAM-GZBFAFLISA-N 0 3 260.381 2.642 20 70 CFIDHN C[C@@H](NC(=O)[C@H](C)N)c1cccc(Cl)c1Cl ZINC000160985615 378813829 /nfs/dbraw/zinc/81/38/29/378813829.db2.gz NBARJVOQTJUJBK-NKWVEPMBSA-N 0 3 261.152 2.518 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 ZINC000161054702 378817470 /nfs/dbraw/zinc/81/74/70/378817470.db2.gz TYMSFHKSOZJNNX-OWCLPIDISA-N 0 3 274.408 2.641 20 70 CFIDHN CCN(C(=O)[C@@H](C)N)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000161115641 378822946 /nfs/dbraw/zinc/82/29/46/378822946.db2.gz GNTHBRXZKWXSPI-ZJUUUORDSA-N 0 3 288.313 2.962 20 70 CFIDHN CCCN(CCc1cccc(F)c1)CC(OC)OC ZINC000161110637 378823230 /nfs/dbraw/zinc/82/32/30/378823230.db2.gz MMYFIHIIXMBQQN-UHFFFAOYSA-N 0 3 269.360 2.699 20 70 CFIDHN CCC[C@H](N)C(=O)NC(C)(C)c1cccc(Cl)c1 ZINC000161163153 378827314 /nfs/dbraw/zinc/82/73/14/378827314.db2.gz FDWXRNFVLSCNQL-LBPRGKRZSA-N 0 3 268.788 2.819 20 70 CFIDHN Cc1ccc([C@H](C)CNC(=O)C2(N)CCCCC2)cc1 ZINC000161170990 378827565 /nfs/dbraw/zinc/82/75/65/378827565.db2.gz YRHMZXRREYUIKV-CQSZACIVSA-N 0 3 274.408 2.876 20 70 CFIDHN NC1(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)CC1 ZINC000161333547 378839881 /nfs/dbraw/zinc/83/98/81/378839881.db2.gz DNNGXIDMWIWYSL-UHFFFAOYSA-N 0 3 278.327 2.577 20 70 CFIDHN CCOC(=O)[C@H]1CC[C@@H](NCc2ccco2)C[C@@H]1C ZINC000161481231 378851022 /nfs/dbraw/zinc/85/10/22/378851022.db2.gz SOFMJNFLZMULJW-SCRDCRAPSA-N 0 3 265.353 2.737 20 70 CFIDHN CS[C@@H](C)CC(=O)NC[C@H](c1ccc(C)cc1)N(C)C ZINC000161378190 295632824 /nfs/dbraw/zinc/63/28/24/295632824.db2.gz HLDNGRBEEZUZJQ-DZGCQCFKSA-N 0 3 294.464 2.856 20 70 CFIDHN C[C@@H]1C[C@H](NCCO)c2cccc(Br)c21 ZINC000159706738 394365602 /nfs/dbraw/zinc/36/56/02/394365602.db2.gz QTXGXCJEDOVNNH-KCJUWKMLSA-N 0 3 270.170 2.579 20 70 CFIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1cc(C)no1 ZINC000160515012 394366540 /nfs/dbraw/zinc/36/65/40/394366540.db2.gz UDZMCBHXLWCWFC-PWSUYJOCSA-N 0 3 267.373 2.678 20 70 CFIDHN CCO[C@@H]1C[C@@H](NC(=O)[C@@H](N)CC(C)C)C12CCCCC2 ZINC000161182887 286271131 /nfs/dbraw/zinc/27/11/31/286271131.db2.gz DINMGSCHLDJQLY-RRFJBIMHSA-N 0 3 296.455 2.604 20 70 CFIDHN CC[C@H](N)C(=O)N1CC2(CCCC2)c2ccccc21 ZINC000161014044 287924993 /nfs/dbraw/zinc/92/49/93/287924993.db2.gz NHSCSVAVWPOFFN-ZDUSSCGKSA-N 0 3 258.365 2.582 20 70 CFIDHN CN1CCC[C@@H](CNC(=O)CC/C=C/c2ccccc2)C1 ZINC000159506611 322323490 /nfs/dbraw/zinc/32/34/90/322323490.db2.gz APLWBVCANVPUCA-HQWZXOHUSA-N 0 3 286.419 2.938 20 70 CFIDHN Cc1ccccc1[C@H](C)NCCOC[C@H]1CCCO1 ZINC000159644427 322325745 /nfs/dbraw/zinc/32/57/45/322325745.db2.gz UEGGNUXHICDCSL-LSDHHAIUSA-N 0 3 263.381 2.841 20 70 CFIDHN CC1(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC1 ZINC000159664201 322326207 /nfs/dbraw/zinc/32/62/07/322326207.db2.gz MYVZFYXINULQEH-OAHLLOKOSA-N 0 3 272.392 2.740 20 70 CFIDHN C[C@@H](NC[C@H](C)N1CCc2ccccc2C1)c1cnccn1 ZINC000159807088 322328537 /nfs/dbraw/zinc/32/85/37/322328537.db2.gz CGSUFVRILURWSX-LSDHHAIUSA-N 0 3 296.418 2.574 20 70 CFIDHN C[C@H](CNC(=O)C1CCC(C)(C)CC1)N(C)C1CC1 ZINC000159917272 322330498 /nfs/dbraw/zinc/33/04/98/322330498.db2.gz CLTDTLDHRIJGAU-GFCCVEGCSA-N 0 3 266.429 2.802 20 70 CFIDHN CCCCN(C)CCNC(=O)[C@H](C)c1cccs1 ZINC000159952001 322330831 /nfs/dbraw/zinc/33/08/31/322330831.db2.gz RKLKJHJASSEUCL-GFCCVEGCSA-N 0 3 268.426 2.700 20 70 CFIDHN CO[C@@]1(CNCc2ccc(C(F)F)cc2)CCOC1 ZINC000160106869 322333034 /nfs/dbraw/zinc/33/30/34/322333034.db2.gz IUZQNGUMVQULGV-CQSZACIVSA-N 0 3 271.307 2.519 20 70 CFIDHN CC1CCC(O)(CN2CCN(c3cccs3)CC2)CC1 ZINC000160305926 322336421 /nfs/dbraw/zinc/33/64/21/322336421.db2.gz CNAVNNMDDDJQGC-UHFFFAOYSA-N 0 3 294.464 2.811 20 70 CFIDHN CCN(CCCS(=O)(=O)C(C)C)C1CCCCC1 ZINC000160764495 322342917 /nfs/dbraw/zinc/34/29/17/322342917.db2.gz GHQITAVQUFPRSP-UHFFFAOYSA-N 0 3 275.458 2.854 20 70 CFIDHN CC(C)N(CCc1nccs1)C[C@H]1CCCO1 ZINC000159873623 519651357 /nfs/dbraw/zinc/65/13/57/519651357.db2.gz SUDPLNOSACADDG-GFCCVEGCSA-N 0 3 254.399 2.575 20 70 CFIDHN CCCCSCCC(=O)NCCN1CCCC[C@H]1C ZINC000159894775 520951359 /nfs/dbraw/zinc/95/13/59/520951359.db2.gz MYZGDMIEIBFPFE-CQSZACIVSA-N 0 3 286.485 2.900 20 70 CFIDHN CCOc1ccc([C@H](C)N[C@@H](CCO)CSC)cc1 ZINC000160403949 521260728 /nfs/dbraw/zinc/26/07/28/521260728.db2.gz GARFCEFOFIUSCH-JSGCOSHPSA-N 0 3 283.437 2.850 20 70 CFIDHN CCN1CCCC[C@@H]1CN[C@@H](C)c1cncs1 ZINC000161173583 521597209 /nfs/dbraw/zinc/59/72/09/521597209.db2.gz WGAISUPGXRXSGC-NWDGAFQWSA-N 0 3 253.415 2.668 20 70 CFIDHN CC[C@H](C)c1cc(C(=O)NCCN2CCCC[C@@H]2C)on1 ZINC000160581856 522029179 /nfs/dbraw/zinc/02/91/79/522029179.db2.gz OYRLICWMAUMBPR-STQMWFEESA-N 0 3 293.411 2.792 20 70 CFIDHN CCc1nc(CN2CCC[C@H]2C(C)(C)CC)n[nH]1 ZINC000159450236 522308602 /nfs/dbraw/zinc/30/86/02/522308602.db2.gz QWHZNBZVZZIHDE-NSHDSACASA-N 0 3 250.390 2.768 20 70 CFIDHN COC(CN1CC[C@H](c2ccccc2)[C@H](C)C1)OC ZINC000161255200 522532918 /nfs/dbraw/zinc/53/29/18/522532918.db2.gz LCKNAHKVQZQYDN-HIFRSBDPSA-N 0 3 263.381 2.731 20 70 CFIDHN COCc1cccc(CNC[C@@H]2CCC(C)(C)O2)c1 ZINC000160226788 523053643 /nfs/dbraw/zinc/05/36/43/523053643.db2.gz MZOKZHSGQSFRKP-HNNXBMFYSA-N 0 3 263.381 2.880 20 70 CFIDHN C[C@H]1CN(C)CC[C@@H]1N(C)c1nc(C(C)(C)C)ns1 ZINC000159860836 524560129 /nfs/dbraw/zinc/56/01/29/524560129.db2.gz RJMZSMQZZUPTIL-QWRGUYRKSA-N 0 3 282.457 2.612 20 70 CFIDHN C[C@H]1CN2CCC[C@@H]2CN1c1nc(C(C)(C)C)ns1 ZINC000159475038 524687236 /nfs/dbraw/zinc/68/72/36/524687236.db2.gz DMIXABLNBZWOHH-WDEREUQCSA-N 0 3 280.441 2.509 20 70 CFIDHN CSCCCCC(=O)N1CCN(C2CCCC2)CC1 ZINC000159515234 525396899 /nfs/dbraw/zinc/39/68/99/525396899.db2.gz FQXLSSUFHLSJRS-UHFFFAOYSA-N 0 3 284.469 2.607 20 70 CFIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccc(C)cc1 ZINC000160397080 525641250 /nfs/dbraw/zinc/64/12/50/525641250.db2.gz AEIQYPQWJWNMJX-GXTWGEPZSA-N 0 3 253.411 2.760 20 70 CFIDHN Cc1noc(C)c1CN1CCN(CCC2CCCC2)CC1 ZINC000159712513 526504028 /nfs/dbraw/zinc/50/40/28/526504028.db2.gz ZKICIQDYACUGHT-UHFFFAOYSA-N 0 3 291.439 2.989 20 70 CFIDHN CC1CCN(CCNCc2cc(F)cc(F)c2)CC1 ZINC000160090434 528247202 /nfs/dbraw/zinc/24/72/02/528247202.db2.gz XFQXLRRRGPFADM-UHFFFAOYSA-N 0 3 268.351 2.786 20 70 CFIDHN CCOCCCN(Cc1ccco1)C[C@@H]1CCCO1 ZINC000159587114 528659026 /nfs/dbraw/zinc/65/90/26/528659026.db2.gz NDVCZSWBHYEXDH-HNNXBMFYSA-N 0 3 267.369 2.687 20 70 CFIDHN CCc1ccc([C@H](C)CC(=O)NC[C@@H]2CCCN2C)cc1 ZINC000160134017 348016037 /nfs/dbraw/zinc/01/60/37/348016037.db2.gz KPOKJBCSPOHBPX-PBHICJAKSA-N 0 3 288.435 2.953 20 70 CFIDHN CCCn1nccc1CNCCc1cccc(C)c1 ZINC000160132499 540669183 /nfs/dbraw/zinc/66/91/83/540669183.db2.gz GYFSMYSIVKHPRQ-UHFFFAOYSA-N 0 3 257.381 2.934 20 70 CFIDHN C[C@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159386608 540991726 /nfs/dbraw/zinc/99/17/26/540991726.db2.gz IJHOBHKXTZMPJI-ZFWWWQNUSA-N 0 3 287.407 2.523 20 70 CFIDHN CCN(CC)C(=O)[C@H](NC1CC=CC1)c1ccccc1 ZINC000160892868 541491779 /nfs/dbraw/zinc/49/17/79/541491779.db2.gz YGUKUVOKNVSOAP-MRXNPFEDSA-N 0 3 272.392 2.904 20 70 CFIDHN Cc1ccc(NC(=O)[C@@H]2CCCCN2)cc1OC(F)F ZINC000160091190 378748464 /nfs/dbraw/zinc/74/84/64/378748464.db2.gz TYSKIMCPPPTNRH-NSHDSACASA-N 0 3 284.306 2.677 20 70 CFIDHN CC1(C)C[C@@H](NCc2cn3ccccc3n2)C(C)(C)O1 ZINC000159434856 378708944 /nfs/dbraw/zinc/70/89/44/378708944.db2.gz FKTJRHFCZIPWCR-CYBMUJFWSA-N 0 3 273.380 2.770 20 70 CFIDHN CCc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)o1 ZINC000159595687 378718967 /nfs/dbraw/zinc/71/89/67/378718967.db2.gz XXPZYUMOZCROQU-ZNMIVQPWSA-N 0 3 261.365 2.889 20 70 CFIDHN C[C@H](NC(=O)[C@@H]1CCCCN1)c1ccc(F)cc1Cl ZINC000159627653 378721956 /nfs/dbraw/zinc/72/19/56/378721956.db2.gz NMPKIBMDSWIUBV-ZANVPECISA-N 0 3 284.762 2.798 20 70 CFIDHN CN(Cc1cccc(OC(F)F)c1)C[C@H]1CCC[C@@H]1O ZINC000159715320 378726279 /nfs/dbraw/zinc/72/62/79/378726279.db2.gz MNCLHRDRWPNHBC-OCCSQVGLSA-N 0 3 285.334 2.881 20 70 CFIDHN CCN1CCCN(C(=O)N[C@H](C)c2ccc(C)cc2)CC1 ZINC000159707158 378726475 /nfs/dbraw/zinc/72/64/75/378726475.db2.gz RBWBVTCWQKTFDY-OAHLLOKOSA-N 0 3 289.423 2.793 20 70 CFIDHN CCc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1 ZINC000160332302 378763787 /nfs/dbraw/zinc/76/37/87/378763787.db2.gz ZIPOWMFLYRODMU-BLLLJJGKSA-N 0 3 284.407 2.815 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(Cl)s1)CC2 ZINC000160370265 378766134 /nfs/dbraw/zinc/76/61/34/378766134.db2.gz OVDMBGOAHFAPIK-WCBMZHEXSA-N 0 3 296.827 2.967 20 70 CFIDHN Cc1ccc([C@@H](C)NCC(=O)NCC(F)(F)F)cc1C ZINC000160557834 378780543 /nfs/dbraw/zinc/78/05/43/378780543.db2.gz GROSXGPCVGQTEZ-LLVKDONJSA-N 0 3 288.313 2.633 20 70 CFIDHN CCc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)s1 ZINC000160559600 378782937 /nfs/dbraw/zinc/78/29/37/378782937.db2.gz XGBVGMAGNYDWBC-PWSUYJOCSA-N 0 3 290.436 2.876 20 70 CFIDHN C[C@H](O)C(C)(C)NCc1cc(Br)cs1 ZINC000160618615 378786484 /nfs/dbraw/zinc/78/64/84/378786484.db2.gz SKSWLNLKNMONCN-ZETCQYMHSA-N 0 3 278.215 2.760 20 70 CFIDHN CC[C@H](NCCCNC(C)=O)c1ccc(F)cc1F ZINC000160718429 378793596 /nfs/dbraw/zinc/79/35/96/378793596.db2.gz OOKNRRXKNHZTPV-AWEZNQCLSA-N 0 3 270.323 2.532 20 70 CFIDHN CC[C@@H](NCC(=O)NCC(F)(F)F)c1ccc(F)cc1 ZINC000160786954 378797853 /nfs/dbraw/zinc/79/78/53/378797853.db2.gz RXQDHBRNRVUCBN-LLVKDONJSA-N 0 3 292.276 2.545 20 70 CFIDHN CC[C@H](N[C@@H]1CCC(=O)N(C)C1)c1ccc(F)cc1F ZINC000161201297 378829762 /nfs/dbraw/zinc/82/97/62/378829762.db2.gz NEAPDGIMRFDDCU-RISCZKNCSA-N 0 3 282.334 2.626 20 70 CFIDHN Cc1cc(CN2CCC(C)(O)CC2)c2ccccc2n1 ZINC000161198264 378830015 /nfs/dbraw/zinc/83/00/15/378830015.db2.gz JOQBRIKJSPKQTF-UHFFFAOYSA-N 0 3 270.376 2.890 20 70 CFIDHN CC[C@H](NC(=O)[C@@H](N)C(C)C)c1ccc(F)cc1F ZINC000161210069 378831293 /nfs/dbraw/zinc/83/12/93/378831293.db2.gz BGFKKJSQVLRMIO-STQMWFEESA-N 0 3 270.323 2.515 20 70 CFIDHN C[C@@H]1C[C@H](Nc2cnccn2)CN1Cc1ccccc1 ZINC000160930469 378809305 /nfs/dbraw/zinc/80/93/05/378809305.db2.gz MSQYLGMPNVDXRE-HIFRSBDPSA-N 0 3 268.364 2.552 20 70 CFIDHN Cc1ccc([C@@H](C)CNC(=O)C2(N)CCCCC2)cc1 ZINC000161170873 378827192 /nfs/dbraw/zinc/82/71/92/378827192.db2.gz YRHMZXRREYUIKV-AWEZNQCLSA-N 0 3 274.408 2.876 20 70 CFIDHN CNCC(=O)N1CCCC[C@@H]1c1cccc(C)c1C ZINC000161337476 378841208 /nfs/dbraw/zinc/84/12/08/378841208.db2.gz XJOOPLMPIQLNLI-OAHLLOKOSA-N 0 3 260.381 2.576 20 70 CFIDHN COC(CN1CC[C@H](C)C[C@H]1c1ccc(C)o1)OC ZINC000161337848 378841257 /nfs/dbraw/zinc/84/12/57/378841257.db2.gz GXQZQALMUJUHOS-AAEUAGOBSA-N 0 3 267.369 2.980 20 70 CFIDHN COC(CN1CC[C@H](C)C[C@@H]1c1ccc(C)o1)OC ZINC000161337977 378841507 /nfs/dbraw/zinc/84/15/07/378841507.db2.gz GXQZQALMUJUHOS-WCQYABFASA-N 0 3 267.369 2.980 20 70 CFIDHN COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)[C@@H](C)N ZINC000161415708 378845800 /nfs/dbraw/zinc/84/58/00/378845800.db2.gz NYBZDQCZHCIBOV-MFKMUULPSA-N 0 3 298.814 2.899 20 70 CFIDHN CCc1ccc(/C=C/C(=O)N(CCN(C)C)C(C)C)o1 ZINC000161320418 378838753 /nfs/dbraw/zinc/83/87/53/378838753.db2.gz NGKALSDNYQPDOA-MDZDMXLPSA-N 0 3 278.396 2.654 20 70 CFIDHN CSC[C@](C)(O)CNCc1cccc2c1OC(C)(C)C2 ZINC000217859527 382787904 /nfs/dbraw/zinc/78/79/04/382787904.db2.gz YRYUYHUKTMLOCK-MRXNPFEDSA-N 0 3 295.448 2.604 20 70 CFIDHN COC(=O)c1occc1CN[C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000217795905 393757768 /nfs/dbraw/zinc/75/77/68/393757768.db2.gz XIVDECVQWQOJJQ-NTZNESFSSA-N 0 3 265.353 2.981 20 70 CFIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1cc(C)no1 ZINC000160515088 394366425 /nfs/dbraw/zinc/36/64/25/394366425.db2.gz UDZMCBHXLWCWFC-JQWIXIFHSA-N 0 3 267.373 2.678 20 70 CFIDHN CC(C)S(=O)(=O)CCCN1CCC[C@@H]1C1CCCC1 ZINC000160968143 394366858 /nfs/dbraw/zinc/36/68/58/394366858.db2.gz IIZULWJSHRIUFP-OAHLLOKOSA-N 0 3 287.469 2.854 20 70 CFIDHN CCC[C@H](N)C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000161396070 276042973 /nfs/dbraw/zinc/04/29/73/276042973.db2.gz AJZYBTMNDDODME-QWHCGFSZSA-N 0 3 276.380 2.532 20 70 CFIDHN CC1CCC(CN(C)C[C@@H](O)C(F)(F)F)CC1 ZINC000159558588 322323913 /nfs/dbraw/zinc/32/39/13/322323913.db2.gz VUNDZZOOQLXZHL-VQXHTEKXSA-N 0 3 253.308 2.668 20 70 CFIDHN CC[C@@H](OC1CCCCC1)C(=O)NC[C@H]1CCCN1CC ZINC000159578838 322324697 /nfs/dbraw/zinc/32/46/97/322324697.db2.gz MEZQOEXTHCUHFE-GDBMZVCRSA-N 0 3 296.455 2.715 20 70 CFIDHN CN(Cc1cc(F)cc2cccnc21)C[C@H]1CCC[C@@H]1O ZINC000159842148 322329337 /nfs/dbraw/zinc/32/93/37/322329337.db2.gz YNTWOIABUVDHCC-CJNGLKHVSA-N 0 3 288.366 2.967 20 70 CFIDHN CO[C@]1(CNCc2ccc(C(F)F)cc2)CCOC1 ZINC000160106739 322333154 /nfs/dbraw/zinc/33/31/54/322333154.db2.gz IUZQNGUMVQULGV-AWEZNQCLSA-N 0 3 271.307 2.519 20 70 CFIDHN C[C@@H](NCCc1ccc2c(c1)OCO2)c1ccco1 ZINC000161145056 322348028 /nfs/dbraw/zinc/34/80/28/322348028.db2.gz JSKCJOVJVOOLFO-LLVKDONJSA-N 0 3 259.305 2.902 20 70 CFIDHN COc1ccc([C@H](C)N[C@@H]2CCC(=O)N(C)C2)cc1Cl ZINC000161203933 322348734 /nfs/dbraw/zinc/34/87/34/322348734.db2.gz MQXWJWHRDCRHHY-CMPLNLGQSA-N 0 3 296.798 2.620 20 70 CFIDHN CC(C)[C@@H](N)C(=O)Nc1ccc2nn(C(C)C)cc2c1 ZINC000160069770 519796098 /nfs/dbraw/zinc/79/60/98/519796098.db2.gz DBVOIIUIFKQEIY-CQSZACIVSA-N 0 3 274.368 2.539 20 70 CFIDHN CCCCCCC(=O)N1CCCN(CCC)CC1 ZINC000160404965 519950189 /nfs/dbraw/zinc/95/01/89/519950189.db2.gz WIQNXFUMGGHODQ-UHFFFAOYSA-N 0 3 254.418 2.901 20 70 CFIDHN CCO[C@@H]1C[C@@H](NCc2cnn3ccccc23)C1(C)C ZINC000217871228 520374650 /nfs/dbraw/zinc/37/46/50/520374650.db2.gz GGKBAJIKXNLARV-HUUCEWRRSA-N 0 3 273.380 2.628 20 70 CFIDHN CCOc1ccccc1[C@@H](C)N[C@H](CCO)CSC ZINC000160366837 521572637 /nfs/dbraw/zinc/57/26/37/521572637.db2.gz FFVQXURSKBJFTF-CHWSQXEVSA-N 0 3 283.437 2.850 20 70 CFIDHN CC[C@@H](N[C@@H](CCO)CSC)c1ccccc1OC ZINC000160375267 522919577 /nfs/dbraw/zinc/91/95/77/522919577.db2.gz JRBRVYYUXKVODF-GXTWGEPZSA-N 0 3 283.437 2.850 20 70 CFIDHN C[C@H](CN1CCCC1=O)NCc1coc2ccccc12 ZINC000161092981 524326032 /nfs/dbraw/zinc/32/60/32/524326032.db2.gz ZDGZRQZUNFQFES-GFCCVEGCSA-N 0 3 272.348 2.533 20 70 CFIDHN COc1ccccc1C(C)(C)NCCOCC1CC1 ZINC000160550333 524365123 /nfs/dbraw/zinc/36/51/23/524365123.db2.gz RJHRQXCDGCGFAN-UHFFFAOYSA-N 0 3 263.381 2.947 20 70 CFIDHN C[C@H]1C[C@H](N(C)c2nc(C(C)(C)C)ns2)CCN1C ZINC000159624387 524903602 /nfs/dbraw/zinc/90/36/02/524903602.db2.gz MHUHMTQUFZENDL-WDEREUQCSA-N 0 3 282.457 2.755 20 70 CFIDHN COc1ccc([C@H](C)N[C@@H](CCO)CSC)cc1F ZINC000160218373 525329294 /nfs/dbraw/zinc/32/92/94/525329294.db2.gz LWYJXAHKJKWYOI-JQWIXIFHSA-N 0 3 287.400 2.599 20 70 CFIDHN Cc1ccccc1[C@H](C)NCC(=O)N(C)CC(F)(F)F ZINC000159679201 525415052 /nfs/dbraw/zinc/41/50/52/525415052.db2.gz STDZZSFGXSGXHG-NSHDSACASA-N 0 3 288.313 2.666 20 70 CFIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccc(F)cc1 ZINC000160355907 525642868 /nfs/dbraw/zinc/64/28/68/525642868.db2.gz ZWYXWWXPYOJYKD-GXFFZTMASA-N 0 3 257.374 2.590 20 70 CFIDHN c1sc(C2CC2)nc1CN1CCN(CC2CC2)CC1 ZINC000161436067 526631383 /nfs/dbraw/zinc/63/13/83/526631383.db2.gz HETKZKHNBUJCRT-UHFFFAOYSA-N 0 3 277.437 2.548 20 70 CFIDHN CCCCc1ccc([C@@H](C)N[C@H](C)CC(N)=O)cc1 ZINC000161359391 529028216 /nfs/dbraw/zinc/02/82/16/529028216.db2.gz JRHKFPYIDJDOMM-CHWSQXEVSA-N 0 3 262.397 2.944 20 70 CFIDHN CC[C@H]1CCC[C@@H](NC(=O)N2CCCN(CC)CC2)C1 ZINC000159894711 529222217 /nfs/dbraw/zinc/22/22/17/529222217.db2.gz WEJCGXJPTVUPAK-LSDHHAIUSA-N 0 3 281.444 2.692 20 70 CFIDHN CNCC(=O)N1CCC[C@H](C)[C@H]1c1ccc(C)cc1 ZINC000159780801 290638497 /nfs/dbraw/zinc/63/84/97/290638497.db2.gz HSQZOOOXOMQNBE-BBRMVZONSA-N 0 3 260.381 2.514 20 70 CFIDHN Cc1cc(C)cc(OCCCN2CCC(C)(O)CC2)c1 ZINC000161199970 232251325 /nfs/dbraw/zinc/25/13/25/232251325.db2.gz WQNALKKAFRHIII-UHFFFAOYSA-N 0 3 277.408 2.919 20 70 CFIDHN CCCCSCCC(=O)N[C@H](C)CN1CCCCC1 ZINC000159751572 282882926 /nfs/dbraw/zinc/88/29/26/282882926.db2.gz KSPJZCRIVFBPIO-CQSZACIVSA-N 0 3 286.485 2.900 20 70 CFIDHN CCCn1nccc1CNC[C@@H](c1cccs1)N(C)C ZINC000159987160 540666870 /nfs/dbraw/zinc/66/68/70/540666870.db2.gz KICGSUQXGOEJSE-AWEZNQCLSA-N 0 3 292.452 2.747 20 70 CFIDHN Fc1cc(Cl)ccc1CN[C@@H]1C[C@H]2CC[C@@H]1O2 ZINC000160863962 540682086 /nfs/dbraw/zinc/68/20/86/540682086.db2.gz OHOSFVWULHOQGA-RTXFEEFZSA-N 0 3 255.720 2.889 20 70 CFIDHN CC1(C)CCC(C(=O)N[C@H]2CCN(CC3CC3)C2)CC1 ZINC000160144806 541022005 /nfs/dbraw/zinc/02/20/05/541022005.db2.gz QLOFLBOJCYMFMN-HNNXBMFYSA-N 0 3 278.440 2.803 20 70 CFIDHN CCCC[C@H](NC1CC=CC1)C(=O)Nc1cc(C)on1 ZINC000160893410 541492033 /nfs/dbraw/zinc/49/20/33/541492033.db2.gz YZPZQUCNXQIDOW-ZDUSSCGKSA-N 0 3 277.368 2.789 20 70 CFIDHN CCC1(CNC(=O)N[C@H]2CCN(CC3CC3)C2)CCCC1 ZINC000161106069 541540639 /nfs/dbraw/zinc/54/06/39/541540639.db2.gz JXDGGSDWRQTXGO-HNNXBMFYSA-N 0 3 293.455 2.740 20 70 CFIDHN CC[C@@H](NC[C@H](C)N1CCc2ccccc21)c1cnn(C)c1 ZINC000159903486 378737770 /nfs/dbraw/zinc/73/77/70/378737770.db2.gz RDDKSSAIUYDYJA-WMLDXEAASA-N 0 3 298.434 2.912 20 70 CFIDHN CCOc1cccc(CN[C@@H](C)CC(=O)N(CC)CC)c1 ZINC000159408872 378706409 /nfs/dbraw/zinc/70/64/09/378706409.db2.gz GJJAEBHFMUXCER-AWEZNQCLSA-N 0 3 292.423 2.822 20 70 CFIDHN COc1ccc(C)cc1[C@H](C)NCCCN1CCCC1=O ZINC000159513147 378714292 /nfs/dbraw/zinc/71/42/92/378714292.db2.gz KBZFQXHNLINLCE-AWEZNQCLSA-N 0 3 290.407 2.667 20 70 CFIDHN C[C@H](NCCCN1CCCC1=O)c1cc(F)cc(F)c1 ZINC000159532006 378714901 /nfs/dbraw/zinc/71/49/01/378714901.db2.gz WUEUWKGFLNRWQB-NSHDSACASA-N 0 3 282.334 2.628 20 70 CFIDHN CC[C@H](NC(=O)[C@@H](N)CC(C)C)c1ccc(F)cc1F ZINC000159725519 378727537 /nfs/dbraw/zinc/72/75/37/378727537.db2.gz MHNYCZODKZJVOI-KBPBESRZSA-N 0 3 284.350 2.906 20 70 CFIDHN CC(C)[C@H](C(=O)N[C@@H]1CCCc2sccc21)N(C)C ZINC000160265045 378761063 /nfs/dbraw/zinc/76/10/63/378761063.db2.gz LEVGHOCHFRXUQY-TZMCWYRMSA-N 0 3 280.437 2.828 20 70 CFIDHN CCc1ncnc(N2CCC[C@@H]2CN2CCCCC2)c1F ZINC000160458518 378773989 /nfs/dbraw/zinc/77/39/89/378773989.db2.gz LTLGABITVKUJDR-CYBMUJFWSA-N 0 3 292.402 2.633 20 70 CFIDHN Cc1nc2n(n1)C[C@@H](N[C@@H]1CCCc3sccc31)CC2 ZINC000160493224 378775495 /nfs/dbraw/zinc/77/54/95/378775495.db2.gz PUEWRNHZNFWYFO-WCQYABFASA-N 0 3 288.420 2.630 20 70 CFIDHN Cc1nc(C)c(C(=O)NC[C@H]2CCCN2CC(C)C)s1 ZINC000160536426 378778871 /nfs/dbraw/zinc/77/88/71/378778871.db2.gz QYYGSUVNDWALMF-CYBMUJFWSA-N 0 3 295.452 2.610 20 70 CFIDHN CCc1nnc(CN[C@H](C)[C@H](C)c2ccccc2)[nH]1 ZINC000160563697 378782480 /nfs/dbraw/zinc/78/24/80/378782480.db2.gz BICDJGAHAHBNRZ-NWDGAFQWSA-N 0 3 258.369 2.649 20 70 CFIDHN CCc1nnc(C[NH2+][C@H](C)[C@H](C)c2ccccc2)[n-]1 ZINC000160563697 378782491 /nfs/dbraw/zinc/78/24/91/378782491.db2.gz BICDJGAHAHBNRZ-NWDGAFQWSA-N 0 3 258.369 2.649 20 70 CFIDHN C[C@@H](NC[C@H](C)N(C)Cc1ccccc1)c1cnn(C)c1 ZINC000160866450 378805169 /nfs/dbraw/zinc/80/51/69/378805169.db2.gz WMGHNYFKUHKADC-LSDHHAIUSA-N 0 3 286.423 2.591 20 70 CFIDHN C[C@@H](C(=O)N1CCCNCC1)c1ccc2ccccc2c1 ZINC000160871400 378806305 /nfs/dbraw/zinc/80/63/05/378806305.db2.gz OYOFMBMZIZKFIE-CQSZACIVSA-N 0 3 282.387 2.765 20 70 CFIDHN c1cc2c(s1)CCC[C@@H]2NCc1cnc2cnccn12 ZINC000160952383 378812061 /nfs/dbraw/zinc/81/20/61/378812061.db2.gz ZTJYXVBCXJDMGH-ZDUSSCGKSA-N 0 3 284.388 2.958 20 70 CFIDHN CCN(CC(OC)OC)[C@@H](C)Cc1ccc(OC)cc1 ZINC000161035184 378816935 /nfs/dbraw/zinc/81/69/35/378816935.db2.gz FFNJMJZOIIGFRQ-ZDUSSCGKSA-N 0 3 281.396 2.567 20 70 CFIDHN Cc1ncc([C@H](C)NC[C@@H](CO)c2ccccc2)c(C)n1 ZINC000161469654 378850021 /nfs/dbraw/zinc/85/00/21/378850021.db2.gz KVGFVHFLAOLTLI-LRDDRELGSA-N 0 3 285.391 2.520 20 70 CFIDHN Cc1ccc(NC(=O)[C@@H](C)N)cc1OCCC(C)C ZINC000161509689 378852647 /nfs/dbraw/zinc/85/26/47/378852647.db2.gz RIXGGRONWOANJS-GFCCVEGCSA-N 0 3 264.369 2.706 20 70 CFIDHN c1cnc(CNCC2C3CC4CC(C3)CC2C4)cn1 ZINC000216834209 382784785 /nfs/dbraw/zinc/78/47/85/382784785.db2.gz PQYBCACXDPXOKW-UHFFFAOYSA-N 0 3 257.381 2.639 20 70 CFIDHN C[C@@H](NCC12CC3CC(CC(C3)C1)C2)c1nncn1C ZINC000216824539 382784830 /nfs/dbraw/zinc/78/48/30/382784830.db2.gz BMDXFFPPHPSLQO-UWJCENJNSA-N 0 3 274.412 2.682 20 70 CFIDHN CCN(C)C(=O)CN[C@H]1CCCc2c3ccccc3[nH]c21 ZINC000217350763 382785693 /nfs/dbraw/zinc/78/56/93/382785693.db2.gz CTEUMWFGVSAGJI-HNNXBMFYSA-N 0 3 285.391 2.613 20 70 CFIDHN CSC[C@@](C)(O)CNCc1cccc2c1OC(C)(C)C2 ZINC000217859406 382787862 /nfs/dbraw/zinc/78/78/62/382787862.db2.gz YRYUYHUKTMLOCK-INIZCTEOSA-N 0 3 295.448 2.604 20 70 CFIDHN C[C@@H](Cn1cccn1)NCc1cccc2cc[nH]c21 ZINC000218102583 382789292 /nfs/dbraw/zinc/78/92/92/382789292.db2.gz QZQOMBWDUISCRO-LBPRGKRZSA-N 0 3 254.337 2.543 20 70 CFIDHN COC[C@H](O)CN(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000217155705 393756673 /nfs/dbraw/zinc/75/66/73/393756673.db2.gz CKUVHRVFIMCMEC-GXFFZTMASA-N 0 3 291.313 2.706 20 70 CFIDHN CO[C@@]1(C)C[C@H](NCc2ccccc2NC(C)=O)C1(C)C ZINC000160512012 394366405 /nfs/dbraw/zinc/36/64/05/394366405.db2.gz CODOOPPEMDYLKN-RDJZCZTQSA-N 0 3 290.407 2.938 20 70 CFIDHN CC1(C)CC[C@H](NCCNC(=O)C2CC2)c2ccccc21 ZINC000160694678 394366789 /nfs/dbraw/zinc/36/67/89/394366789.db2.gz UCCOAGGOXVNMJG-INIZCTEOSA-N 0 3 286.419 2.915 20 70 CFIDHN C[C@H](N)C(=O)NCC1(Sc2ccccc2)CCCC1 ZINC000159673929 278223907 /nfs/dbraw/zinc/22/39/07/278223907.db2.gz LREXMWCVLWZTFG-LBPRGKRZSA-N 0 3 278.421 2.555 20 70 CFIDHN CCO[C@@H]1C[C@H](NC(=O)[C@@H](N)C(C)(C)C)C12CCCCC2 ZINC000161179132 279857270 /nfs/dbraw/zinc/85/72/70/279857270.db2.gz YXSFAJOTXUTJJU-BFHYXJOUSA-N 0 3 296.455 2.604 20 70 CFIDHN Cc1nc2n(n1)C[C@H](N[C@H](CC(C)C)c1ccccn1)CC2 ZINC000160323955 302683936 /nfs/dbraw/zinc/68/39/36/302683936.db2.gz YWJSOMDVLDJQSG-GDBMZVCRSA-N 0 3 299.422 2.673 20 70 CFIDHN CCC[C@H](N[C@@H]1CCN(C(=O)CC)C1)c1ccccn1 ZINC000159384854 322322182 /nfs/dbraw/zinc/32/21/82/322322182.db2.gz LWUQCZVCZLYPCA-HIFRSBDPSA-N 0 3 275.396 2.523 20 70 CFIDHN CCOC[C@H](O)CN[C@@H](C)c1ccc(SCC)cc1 ZINC000159637689 322325902 /nfs/dbraw/zinc/32/59/02/322325902.db2.gz SWQAGQCJSGUYFA-GXTWGEPZSA-N 0 3 283.437 2.847 20 70 CFIDHN COC(=O)c1ccc(CN2CC[C@@H]3CCCC[C@@H]32)o1 ZINC000159646746 322325940 /nfs/dbraw/zinc/32/59/40/322325940.db2.gz NCDRXZFIRSAMSD-AAEUAGOBSA-N 0 3 263.337 2.831 20 70 CFIDHN CCN(CCNC(=O)C1CCC(C)(C)CC1)C1CC1 ZINC000159785052 322327982 /nfs/dbraw/zinc/32/79/82/322327982.db2.gz ZJDZHKMMKQSCGM-UHFFFAOYSA-N 0 3 266.429 2.803 20 70 CFIDHN CCCCN(C)CCNC(=O)[C@@H](C)c1cccs1 ZINC000159951853 322331036 /nfs/dbraw/zinc/33/10/36/322331036.db2.gz RKLKJHJASSEUCL-LBPRGKRZSA-N 0 3 268.426 2.700 20 70 CFIDHN C[C@H](Cc1cccc(Cl)c1)C(=O)NC1CCN(C)CC1 ZINC000160245272 322335024 /nfs/dbraw/zinc/33/50/24/322335024.db2.gz YUEHCEXSBQVPBN-GFCCVEGCSA-N 0 3 294.826 2.729 20 70 CFIDHN CN1CCC(NC(=O)C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000160243886 322335388 /nfs/dbraw/zinc/33/53/88/322335388.db2.gz BDZCMGIEYCOBHP-ZDUSSCGKSA-N 0 3 266.429 2.803 20 70 CFIDHN C[C@H](Cc1ccc(Cl)cc1)C(=O)NC1CCN(C)CC1 ZINC000160245001 322335416 /nfs/dbraw/zinc/33/54/16/322335416.db2.gz KRWHLSLYYQAAQH-GFCCVEGCSA-N 0 3 294.826 2.729 20 70 CFIDHN C[C@H](NCCc1ccc2c(c1)OCO2)c1cncs1 ZINC000161123334 322347475 /nfs/dbraw/zinc/34/74/75/322347475.db2.gz GTGMTPCFFZKMTK-JTQLQIEISA-N 0 3 276.361 2.765 20 70 CFIDHN CCCCCN1CCC([C@@H](O)C(F)(F)F)CC1 ZINC000161198042 322348535 /nfs/dbraw/zinc/34/85/35/322348535.db2.gz RFPMZRSDKCWERQ-LLVKDONJSA-N 0 3 253.308 2.812 20 70 CFIDHN CCCN(CCO)Cc1ccc(OC(C)C)c(OC)c1 ZINC000161199352 322348659 /nfs/dbraw/zinc/34/86/59/322348659.db2.gz PBQGKPDMOYUFOP-UHFFFAOYSA-N 0 3 281.396 2.687 20 70 CFIDHN C[C@@H](c1ccncc1)N(C)C(=O)c1ccc(CN(C)C)cc1 ZINC000161489324 322352348 /nfs/dbraw/zinc/35/23/48/322352348.db2.gz UWBYGHBJCOMFFS-AWEZNQCLSA-N 0 3 297.402 2.976 20 70 CFIDHN CCCCN(CCOC)Cc1cnc2ccccn12 ZINC000160322608 520536837 /nfs/dbraw/zinc/53/68/37/520536837.db2.gz AMGBQNUXUMIWER-UHFFFAOYSA-N 0 3 261.369 2.583 20 70 CFIDHN CC(C)n1cc([C@H](C)NC[C@H]2CCCC[C@@H]2O)cn1 ZINC000160621985 519979215 /nfs/dbraw/zinc/97/92/15/519979215.db2.gz WLCGBAWUJVQHCL-GUTXKFCHSA-N 0 3 265.401 2.666 20 70 CFIDHN CC[C@H](C)c1cc(C(=O)NCCN2CCCCCC2)on1 ZINC000160223952 522028701 /nfs/dbraw/zinc/02/87/01/522028701.db2.gz ICSLJJAGHLQXJC-ZDUSSCGKSA-N 0 3 293.411 2.794 20 70 CFIDHN CNC(=O)CCNC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000161452200 524069012 /nfs/dbraw/zinc/06/90/12/524069012.db2.gz GVFLBDMFIJFMSC-UHFFFAOYSA-N 0 3 289.206 2.954 20 70 CFIDHN C[C@H]1CCC[C@@H](C(=O)NCCN2CCC[C@H](C)C2)C1 ZINC000160587653 524127101 /nfs/dbraw/zinc/12/71/01/524127101.db2.gz DDTYMFRWJHNQQV-SOUVJXGZSA-N 0 3 266.429 2.661 20 70 CFIDHN Cc1ccc(CN2CCC(Cc3nccn3C)CC2)nc1 ZINC000159967350 524439309 /nfs/dbraw/zinc/43/93/09/524439309.db2.gz BLNBVNMIUWTSFG-UHFFFAOYSA-N 0 3 284.407 2.578 20 70 CFIDHN Cc1cccc([C@@H]2CCCN2CCC(=O)OC(C)C)n1 ZINC000159705980 524851774 /nfs/dbraw/zinc/85/17/74/524851774.db2.gz SYPWYWMZFCYCGC-HNNXBMFYSA-N 0 3 276.380 2.869 20 70 CFIDHN COc1ccc(OC)c([C@@H](C)NCC2(CO)CCCC2)c1 ZINC000160108931 524884249 /nfs/dbraw/zinc/88/42/49/524884249.db2.gz ONWLLRYIUHIBCA-CYBMUJFWSA-N 0 3 293.407 2.907 20 70 CFIDHN Cc1ccc(C(=O)CCN(C)[C@@H](CO)C(C)(C)C)cc1 ZINC000160904243 526042888 /nfs/dbraw/zinc/04/28/88/526042888.db2.gz YKQWATKEVNRXSP-INIZCTEOSA-N 0 3 277.408 2.907 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC[C@H](C)[C@@H]2CO)cc1 ZINC000160944017 526044977 /nfs/dbraw/zinc/04/49/77/526044977.db2.gz BPRMELUYDQDIOK-HOCLYGCPSA-N 0 3 275.392 2.661 20 70 CFIDHN OCCC1(CNCc2ccc(Cl)cc2F)CC1 ZINC000160899094 527533177 /nfs/dbraw/zinc/53/31/77/527533177.db2.gz HYJGLNKJMRMJCT-UHFFFAOYSA-N 0 3 257.736 2.731 20 70 CFIDHN O=C(NCC1(N2CCCCC2)CCCCC1)C(F)F ZINC000217597766 527570941 /nfs/dbraw/zinc/57/09/41/527570941.db2.gz GRXJLBROBGQPBY-UHFFFAOYSA-N 0 3 274.355 2.557 20 70 CFIDHN CCOCCCN1CCC[C@@H](c2nccs2)C1 ZINC000160004766 528659746 /nfs/dbraw/zinc/65/97/46/528659746.db2.gz GAGWZCIVCNNJMQ-GFCCVEGCSA-N 0 3 254.399 2.749 20 70 CFIDHN COC(=O)c1occc1CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159601687 348013360 /nfs/dbraw/zinc/01/33/60/348013360.db2.gz VOCQHEKGTZXBIT-AAEUAGOBSA-N 0 3 263.337 2.831 20 70 CFIDHN CC[C@H](CC(=O)NCCN(C)CC)c1ccc(C)cc1 ZINC000160146812 348016002 /nfs/dbraw/zinc/01/60/02/348016002.db2.gz MJFNQQFSPGGLGD-OAHLLOKOSA-N 0 3 276.424 2.947 20 70 CFIDHN CC(C)CN(CC(C)C)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160636621 348019723 /nfs/dbraw/zinc/01/97/23/348019723.db2.gz WMUWBVWHCNWJMN-MRXNPFEDSA-N 0 3 295.471 2.794 20 70 CFIDHN CCN(C(=O)N[C@H]1CCN(CC2CC2)C1)[C@@H](C)C(C)C ZINC000160758382 348020379 /nfs/dbraw/zinc/02/03/79/348020379.db2.gz MPMATAHIOSAYOW-ZFWWWQNUSA-N 0 3 281.444 2.547 20 70 CFIDHN Cc1ccc([O-])c(C(=O)NCC[NH+]2[C@@H](C)CCC[C@@H]2C)c1 ZINC000217732356 348165399 /nfs/dbraw/zinc/16/53/99/348165399.db2.gz FCQRLPVCRQVUFY-KBPBESRZSA-N 0 3 290.407 2.693 20 70 CFIDHN C/C(=C/c1ccccc1)CN1CCC(CC(N)=O)CC1 ZINC000159791582 188441906 /nfs/dbraw/zinc/44/19/06/188441906.db2.gz MRFBDYAQULQGPL-KAMYIIQDSA-N 0 3 272.392 2.677 20 70 CFIDHN Cc1cc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)ncn1 ZINC000160213154 188460177 /nfs/dbraw/zinc/46/01/77/188460177.db2.gz SOHWQGSYFWODSL-XJKSGUPXSA-N 0 3 282.391 2.717 20 70 CFIDHN Cc1ccccc1OCCN[C@@H]1CCCc2c1cnn2C ZINC000161362499 188524073 /nfs/dbraw/zinc/52/40/73/188524073.db2.gz WSCLGTIDJJORAX-OAHLLOKOSA-N 0 3 285.391 2.775 20 70 CFIDHN CCCn1nccc1CNCCOc1cccc(C)c1 ZINC000160121950 540668387 /nfs/dbraw/zinc/66/83/87/540668387.db2.gz WVLYETRQCRGKJW-UHFFFAOYSA-N 0 3 273.380 2.770 20 70 CFIDHN CCC(C)(CC)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21 ZINC000159494625 540996495 /nfs/dbraw/zinc/99/64/95/540996495.db2.gz XQJIEEXZKPVZFY-KBPBESRZSA-N 0 3 266.429 2.755 20 70 CFIDHN CN(C)CCn1cc(NC(=O)C2CCC(C)(C)CC2)cn1 ZINC000159577151 541000495 /nfs/dbraw/zinc/00/04/95/541000495.db2.gz FYVKNNXQSGUZAZ-UHFFFAOYSA-N 0 3 292.427 2.600 20 70 CFIDHN CCO[C@@H]1CCCN(Cc2c(C)nc3ccccn32)C1 ZINC000160528560 541431402 /nfs/dbraw/zinc/43/14/02/541431402.db2.gz DVLADUOVBUAMRE-CQSZACIVSA-N 0 3 273.380 2.644 20 70 CFIDHN CC[C@@H](C(=O)NC1CCC(C(C)C)CC1)N(C)C ZINC000161244152 541570890 /nfs/dbraw/zinc/57/08/90/541570890.db2.gz HURQDOFMEORGFN-RUXDESIVSA-N 0 3 254.418 2.658 20 70 CFIDHN CC(C)N(C)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C ZINC000159948466 378738619 /nfs/dbraw/zinc/73/86/19/378738619.db2.gz WBIRLSUHELLBMQ-HOCLYGCPSA-N 0 3 289.423 2.557 20 70 CFIDHN Cc1cnc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)nc1 ZINC000160223184 378757554 /nfs/dbraw/zinc/75/75/54/378757554.db2.gz QONXQTKAWRRZHA-GOEBONIOSA-N 0 3 282.391 2.717 20 70 CFIDHN C[C@H](NC1CCN(C(=O)c2ccco2)CC1)c1ccco1 ZINC000160224250 378757682 /nfs/dbraw/zinc/75/76/82/378757682.db2.gz RUNXYMQBZWQZJN-LBPRGKRZSA-N 0 3 288.347 2.828 20 70 CFIDHN CCOC(C)(C)CNCc1nn(CC)c2ccccc12 ZINC000159363901 378704952 /nfs/dbraw/zinc/70/49/52/378704952.db2.gz FCHFHWRGTVZQJE-UHFFFAOYSA-N 0 3 275.396 2.961 20 70 CFIDHN COc1ccc(C)cc1[C@@H](C)NCCCN1CCCC1=O ZINC000159513019 378713480 /nfs/dbraw/zinc/71/34/80/378713480.db2.gz KBZFQXHNLINLCE-CQSZACIVSA-N 0 3 290.407 2.667 20 70 CFIDHN C[C@@H](NCCCN1CCCC1=O)c1cc(F)cc(F)c1 ZINC000159532157 378714934 /nfs/dbraw/zinc/71/49/34/378714934.db2.gz WUEUWKGFLNRWQB-LLVKDONJSA-N 0 3 282.334 2.628 20 70 CFIDHN Cn1c(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)nc2ccccc21 ZINC000159571168 378716661 /nfs/dbraw/zinc/71/66/61/378716661.db2.gz UETVFZYZLOFARS-VUCTXSBTSA-N 0 3 297.402 2.621 20 70 CFIDHN COc1ccccc1CN(CCn1ccnc1)C1CC1 ZINC000159764067 378728693 /nfs/dbraw/zinc/72/86/93/378728693.db2.gz DYMVBRPGHJVCFE-UHFFFAOYSA-N 0 3 271.364 2.556 20 70 CFIDHN O[C@@H]1CCCC[C@@H]1NCc1ccc(Cl)cc1F ZINC000160810938 378800292 /nfs/dbraw/zinc/80/02/92/378800292.db2.gz YVQQHUIMEHJUEK-QWHCGFSZSA-N 0 3 257.736 2.872 20 70 CFIDHN CC1(C)C[C@@H](NCc2cccc3c2OCCCO3)CCO1 ZINC000160540638 378780980 /nfs/dbraw/zinc/78/09/80/378780980.db2.gz FRJBPQQLNYXUSG-AWEZNQCLSA-N 0 3 291.391 2.895 20 70 CFIDHN CC(C)(C)[C@H](N)C(=O)NCC1(c2cccc(Cl)c2)CC1 ZINC000160546287 378781285 /nfs/dbraw/zinc/78/12/85/378781285.db2.gz ISCJDXUHIYJAOY-CYBMUJFWSA-N 0 3 294.826 2.861 20 70 CFIDHN CC[C@@H](C)CN(CC)[C@H](C(N)=O)c1ccc(F)cc1 ZINC000160583545 378784176 /nfs/dbraw/zinc/78/41/76/378784176.db2.gz DLBRFPNKDLQGCS-RISCZKNCSA-N 0 3 266.360 2.720 20 70 CFIDHN CCN1CCCC[C@@H]1CN[C@@H](C)c1cncc(F)c1 ZINC000161198257 378829952 /nfs/dbraw/zinc/82/99/52/378829952.db2.gz SGNFBQJMBGTROH-SWLSCSKDSA-N 0 3 265.376 2.746 20 70 CFIDHN CC(C)C1(CNC(=O)[C@@H](C)[C@@H](N)c2ccccc2)CC1 ZINC000160818864 378801723 /nfs/dbraw/zinc/80/17/23/378801723.db2.gz DYXCPGKMKJBJPT-DZGCQCFKSA-N 0 3 274.408 2.875 20 70 CFIDHN Cc1nccc(N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)n1 ZINC000160867715 378805743 /nfs/dbraw/zinc/80/57/43/378805743.db2.gz RNZKLYKKNXOYIK-CJNGLKHVSA-N 0 3 282.391 2.860 20 70 CFIDHN c1cc2c(s1)CCC[C@H]2NCc1cnc2cnccn12 ZINC000160952269 378811952 /nfs/dbraw/zinc/81/19/52/378811952.db2.gz ZTJYXVBCXJDMGH-CYBMUJFWSA-N 0 3 284.388 2.958 20 70 CFIDHN C[C@@H](O)C(C)(C)NCc1cc(Cl)c2c(c1)OCCCO2 ZINC000161136741 378824617 /nfs/dbraw/zinc/82/46/17/378824617.db2.gz WHNHQJAFFMDKLN-SNVBAGLBSA-N 0 3 299.798 2.750 20 70 CFIDHN C[C@@H](N)C(=O)Nc1cccc(Cl)c1SCC(F)F ZINC000161129454 378824696 /nfs/dbraw/zinc/82/46/96/378824696.db2.gz GLWBPHARGNOLOA-ZCFIWIBFSA-N 0 3 294.754 2.983 20 70 CFIDHN C[C@H](NC[C@H](CO)c1ccccc1)c1cncs1 ZINC000161467791 378849243 /nfs/dbraw/zinc/84/92/43/378849243.db2.gz NWTHJCJIAKLFLN-WCQYABFASA-N 0 3 262.378 2.570 20 70 CFIDHN C[C@@H](NC[C@H](CO)c1ccccc1)c1cncs1 ZINC000161467928 378849526 /nfs/dbraw/zinc/84/95/26/378849526.db2.gz NWTHJCJIAKLFLN-DGCLKSJQSA-N 0 3 262.378 2.570 20 70 CFIDHN CC1(C(=O)N2CCC2)CCN(Cc2ccccc2)CC1 ZINC000161507496 378853471 /nfs/dbraw/zinc/85/34/71/378853471.db2.gz YHKDMGBUGGTMCO-UHFFFAOYSA-N 0 3 272.392 2.521 20 70 CFIDHN CC(C)N(CCc1nccs1)Cc1ccccn1 ZINC000159748066 322327475 /nfs/dbraw/zinc/32/74/75/322327475.db2.gz AWNTYRSWPKXUCQ-UHFFFAOYSA-N 0 3 261.394 2.991 20 70 CFIDHN CSC[C@](C)(O)CNCc1ccc(OC(C)C)cc1 ZINC000217866164 382788046 /nfs/dbraw/zinc/78/80/46/382788046.db2.gz BJYOVZWVZUIAAH-OAHLLOKOSA-N 0 3 283.437 2.677 20 70 CFIDHN CC(C)COCCCNCc1nn(C)c2ccccc12 ZINC000218081338 382788686 /nfs/dbraw/zinc/78/86/86/382788686.db2.gz QUYVWLLLLCYYOC-UHFFFAOYSA-N 0 3 275.396 2.726 20 70 CFIDHN CCCC[C@@H](COC)N[C@H](CCO)c1ccccc1 ZINC000161046216 394366834 /nfs/dbraw/zinc/36/68/34/394366834.db2.gz JEVNINMDNOVJNF-JKSUJKDBSA-N 0 3 265.397 2.905 20 70 CFIDHN C[C@@H]1CCC[C@@H](C(=O)NCCN2CCC[C@H](C)C2)C1 ZINC000160587523 287372131 /nfs/dbraw/zinc/37/21/31/287372131.db2.gz DDTYMFRWJHNQQV-QLFBSQMISA-N 0 3 266.429 2.661 20 70 CFIDHN C[C@H](N[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C)c1ccccn1 ZINC000160815784 278278593 /nfs/dbraw/zinc/27/85/93/278278593.db2.gz QGRHKPMDIODIMW-MXYBEHONSA-N 0 3 260.381 2.936 20 70 CFIDHN CN1CCC[C@H](CNC(=O)N2CCC3(CCCC3)CC2)C1 ZINC000159457426 322322901 /nfs/dbraw/zinc/32/29/01/322322901.db2.gz SNFBKQLMSCBNPL-OAHLLOKOSA-N 0 3 293.455 2.694 20 70 CFIDHN CN(Cc1cc(F)cc2cccnc21)C[C@@H]1CCC[C@@H]1O ZINC000159842003 322329353 /nfs/dbraw/zinc/32/93/53/322329353.db2.gz YNTWOIABUVDHCC-BBRMVZONSA-N 0 3 288.366 2.967 20 70 CFIDHN CC[C@@H](CNC(=O)[C@@H](C(C)C)N(C)C)c1ccccc1 ZINC000159984768 322331592 /nfs/dbraw/zinc/33/15/92/322331592.db2.gz OWWCZJHOFWVHRV-GOEBONIOSA-N 0 3 276.424 2.883 20 70 CFIDHN CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)[C@H](C)N ZINC000160078024 322332407 /nfs/dbraw/zinc/33/24/07/322332407.db2.gz ATIKFGGYBGUORR-GXFFZTMASA-N 0 3 268.788 2.843 20 70 CFIDHN Cc1c([C@H](C)NCC(C)(C)O)cnn1-c1ccc(F)cc1 ZINC000160607921 322340665 /nfs/dbraw/zinc/34/06/65/322340665.db2.gz RJAPSFGWLXHJGU-NSHDSACASA-N 0 3 291.370 2.741 20 70 CFIDHN CC(C)S(=O)(=O)CCCN(C)[C@H]1CCC[C@@H](C)C1 ZINC000160795176 322342853 /nfs/dbraw/zinc/34/28/53/322342853.db2.gz JWLSDGDIUFPGND-KGLIPLIRSA-N 0 3 275.458 2.710 20 70 CFIDHN Cc1ccc(C(=O)CCN2CCC[C@H]([C@@H](C)O)C2)cc1 ZINC000160934056 322345290 /nfs/dbraw/zinc/34/52/90/322345290.db2.gz HNVIHCQVDGLBDD-ZBFHGGJFSA-N 0 3 275.392 2.661 20 70 CFIDHN CS[C@@H](C)CC(=O)N1CCN(CC2CCCCC2)CC1 ZINC000161434094 322351930 /nfs/dbraw/zinc/35/19/30/322351930.db2.gz NRCZCZNINQRESO-AWEZNQCLSA-N 0 3 298.496 2.853 20 70 CFIDHN