smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cc(N)n(CC(=O)N(C)C[C@@H]2Cc3ccccc3CN2C)n1 ZINC000217140368 241238304 /nfs/dbraw/zinc/23/83/04/241238304.db2.gz WLTVPRQVGKXPFK-INIZCTEOSA-N 0 1 327.432 1.289 50 70 EDIAMN Cc1ccc2nc(CCNC(=O)C[C@H]3C=CS(=O)(=O)C3)[nH]c2c1 ZINC000217994881 241289618 /nfs/dbraw/zinc/28/96/18/241289618.db2.gz QCXMEBOYGPKHDC-GFCCVEGCSA-N 0 1 333.413 1.478 50 70 EDIAMN COC[C@@H]1[C@H](NC(=O)Cc2ccc3nc(C)[nH]c3c2)[C@@H]2CCO[C@H]12 ZINC000218261799 241309671 /nfs/dbraw/zinc/30/96/71/241309671.db2.gz FGDDLMGGMMJHJD-DECQCQTCSA-N 0 1 329.400 1.580 50 70 EDIAMN NC(=O)c1ccc(-c2nc3c([nH]2)CN(C[C@H]2CCOC2)CC3)cc1 ZINC000218739696 241341511 /nfs/dbraw/zinc/34/15/11/241341511.db2.gz ZNQMEXZFGGKAFA-GFCCVEGCSA-N 0 1 326.400 1.570 50 70 EDIAMN Cc1cc(C[C@@H](C)NC(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)n[nH]1 ZINC000161484632 206351944 /nfs/dbraw/zinc/35/19/44/206351944.db2.gz SZAKRZHRTBTGNV-SNVBAGLBSA-N 0 1 343.387 1.826 50 70 EDIAMN CCc1nc(SCC(=O)NC[C@H]2OCCc3ccccc32)n[nH]1 ZINC000216913279 241219292 /nfs/dbraw/zinc/21/92/92/241219292.db2.gz RVSCJLKEJVEKJG-CYBMUJFWSA-N 0 1 332.429 1.889 50 70 EDIAMN CCc1n[nH]c(SCC(=O)NC[C@H]2OCCc3ccccc32)n1 ZINC000216913279 241219297 /nfs/dbraw/zinc/21/92/97/241219297.db2.gz RVSCJLKEJVEKJG-CYBMUJFWSA-N 0 1 332.429 1.889 50 70 EDIAMN Cc1nnc(SCC(=O)N(C)Cc2nc(-c3ccncc3)no2)[nH]1 ZINC000218739559 241340863 /nfs/dbraw/zinc/34/08/63/241340863.db2.gz LSJIDMMJFFXEMH-UHFFFAOYSA-N 0 1 345.388 1.309 50 70 EDIAMN Cc1n[nH]c(SCC(=O)N(C)Cc2nc(-c3ccncc3)no2)n1 ZINC000218739559 241340869 /nfs/dbraw/zinc/34/08/69/241340869.db2.gz LSJIDMMJFFXEMH-UHFFFAOYSA-N 0 1 345.388 1.309 50 70 EDIAMN CC(C)Cc1cc(C(=O)N[C@H]2[C@H]3CCO[C@H]3[C@@H]2N2CCCC2)on1 ZINC000218018423 241292302 /nfs/dbraw/zinc/29/23/02/241292302.db2.gz BVERIGBFABAWIC-XLNGHYISSA-N 0 1 333.432 1.855 50 70 EDIAMN Cc1ccc2nc(CCNC(=O)CCCn3cncn3)[nH]c2c1C ZINC000218073102 241296252 /nfs/dbraw/zinc/29/62/52/241296252.db2.gz BXHSWMWOKCBLKB-UHFFFAOYSA-N 0 1 326.404 1.910 50 70 EDIAMN Cc1c(Cl)c(C(=O)N[C@H]2[C@H]3CCO[C@H]3[C@@H]2N2CCCC2)nn1C ZINC000218230186 278597253 /nfs/dbraw/zinc/59/72/53/278597253.db2.gz OAASOVZVIIXVMZ-DZGBDDFRSA-N 0 1 338.839 1.363 50 70 EDIAMN CCc1c(C(=O)N2CCNCC2)nnn1-c1ccc(OC(C)C)cc1 ZINC000159452982 441814983 /nfs/dbraw/zinc/81/49/83/441814983.db2.gz UKPXGVGXHWNJLU-UHFFFAOYSA-N 0 1 343.431 1.662 50 70 EDIAMN CC(C)c1n[nH]c(NC(=O)COc2ccc3c(c2)NC(=O)CC3)n1 ZINC000218449241 241324949 /nfs/dbraw/zinc/32/49/49/241324949.db2.gz HNEVIYMXDXSIOO-UHFFFAOYSA-N 0 1 329.360 1.830 50 70 EDIAMN CC(C)c1nc(NC(=O)COc2ccc3c(c2)NC(=O)CC3)n[nH]1 ZINC000218449241 241324955 /nfs/dbraw/zinc/32/49/55/241324955.db2.gz HNEVIYMXDXSIOO-UHFFFAOYSA-N 0 1 329.360 1.830 50 70 EDIAMN CC[C@@H](NC(=O)Cc1c[nH]c(=O)[nH]c1=O)c1nc2ccc(C)cc2[nH]1 ZINC000217895763 241281926 /nfs/dbraw/zinc/28/19/26/241281926.db2.gz KKCRAHXXUUOTIS-LLVKDONJSA-N 0 1 341.371 1.058 50 70 EDIAMN NC(=O)c1ccc(-c2nc3c([nH]2)CN(C(=O)[C@H]2CCCO2)CC3)cc1 ZINC000218680247 241338091 /nfs/dbraw/zinc/33/80/91/241338091.db2.gz XNAOWNRPEKOOHU-OAHLLOKOSA-N 0 1 340.383 1.239 50 70 EDIAMN O=C(c1ccccc1N1CCOCC1)N1CCC[C@H](c2nc[nH]n2)C1 ZINC000217038535 241233173 /nfs/dbraw/zinc/23/31/73/241233173.db2.gz MJYSTLDBHIUBMA-AWEZNQCLSA-N 0 1 341.415 1.661 50 70 EDIAMN O=C(c1cc(-c2ccsc2)[nH]n1)N1CCC[C@@]2(CNC(=O)O2)C1 ZINC000217126986 241235082 /nfs/dbraw/zinc/23/50/82/241235082.db2.gz BBCXXZFELWHXKT-OAHLLOKOSA-N 0 1 332.385 1.853 50 70 EDIAMN CCc1ccc(CN(C)C(=O)[C@H](Cc2cnc[nH]2)NC(C)=O)nc1 ZINC000218499790 241327452 /nfs/dbraw/zinc/32/74/52/241327452.db2.gz RCLLEQFQYOFWCO-INIZCTEOSA-N 0 1 329.404 1.073 50 70 EDIAMN CN1CCN(Cc2oc(CN3CCCCCC3)cc(=O)c2O)CC1 ZINC000218279723 241310492 /nfs/dbraw/zinc/31/04/92/241310492.db2.gz BTWMSGIVCAPXSJ-UHFFFAOYSA-N 0 1 335.448 1.469 50 70 EDIAMN Cc1nc([C@@H]2CCCN2C(=O)CN2CCOc3ccccc3C2)n[nH]1 ZINC000217903109 241282981 /nfs/dbraw/zinc/28/29/81/241282981.db2.gz DWGRZEAFCYDQRF-HNNXBMFYSA-N 0 1 341.415 1.671 50 70 EDIAMN O=C(c1ccccc1N1CCCC1)N1CCN(Cc2nnc[nH]2)CC1 ZINC000217561730 241258937 /nfs/dbraw/zinc/25/89/37/241258937.db2.gz RHOYKNWVDCELTF-UHFFFAOYSA-N 0 1 340.431 1.363 50 70 EDIAMN Cc1nc(CCN(C)C(=O)CN2CC[C@@H](c3ccccc3)C2)no1 ZINC000218424569 241322278 /nfs/dbraw/zinc/32/22/78/241322278.db2.gz QYBGYOIRVSFKJF-MRXNPFEDSA-N 0 1 328.416 1.868 50 70 EDIAMN CC(C)c1n[nH]c(NC(=O)CCCc2nnc3ccc(Cl)nn32)n1 ZINC000218206409 241305893 /nfs/dbraw/zinc/30/58/93/241305893.db2.gz IYYNMBPKWZFLMP-UHFFFAOYSA-N 0 1 348.798 1.981 50 70 EDIAMN CC(C)c1nc(NC(=O)CCCc2nnc3ccc(Cl)nn32)n[nH]1 ZINC000218206409 241305896 /nfs/dbraw/zinc/30/58/96/241305896.db2.gz IYYNMBPKWZFLMP-UHFFFAOYSA-N 0 1 348.798 1.981 50 70 EDIAMN O=C([C@H]1CCC[C@@H](O)C1)N1CCN(C2Cc3ccccc3C2)CC1 ZINC000218390856 241319013 /nfs/dbraw/zinc/31/90/13/241319013.db2.gz LIVWYBLWBCVVBC-PKOBYXMFSA-N 0 1 328.456 1.849 50 70 EDIAMN CC[C@H](C(=O)NCc1n[nH]c(-c2ccccc2)n1)N1CCOCC1 ZINC000218379073 241317904 /nfs/dbraw/zinc/31/79/04/241317904.db2.gz PUOYLQPZKWFAOK-CQSZACIVSA-N 0 1 329.404 1.199 50 70 EDIAMN CC[C@H](C(=O)NCc1nc(-c2ccccc2)n[nH]1)N1CCOCC1 ZINC000218379073 241317910 /nfs/dbraw/zinc/31/79/10/241317910.db2.gz PUOYLQPZKWFAOK-CQSZACIVSA-N 0 1 329.404 1.199 50 70 EDIAMN Cc1nc([C@H]2CCCN2C(=O)C2(N3CCOCC3)CCCCC2)n[nH]1 ZINC000217143185 241239082 /nfs/dbraw/zinc/23/90/82/241239082.db2.gz SGVGNBUPIWSWBN-OAHLLOKOSA-N 0 1 347.463 1.812 50 70 EDIAMN OC[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCO1 ZINC000160064640 441856720 /nfs/dbraw/zinc/85/67/20/441856720.db2.gz WKPRXJKIMPCEME-JTQLQIEISA-N 0 1 326.194 1.519 50 70 EDIAMN CCCc1cc(CN(C)C(=O)Cc2nc3nc(C)cc(C)n3n2)n[nH]1 ZINC000217984601 535396142 /nfs/dbraw/zinc/39/61/42/535396142.db2.gz YJSDPAAHORCDEH-UHFFFAOYSA-N 0 1 341.419 1.618 50 70 EDIAMN Cn1nccc1[C@H](O)c1cc2n(n1)CCN(CCc1ccccc1)C2 ZINC000218486957 241325862 /nfs/dbraw/zinc/32/58/62/241325862.db2.gz RTAMSSFOLPYHTG-LJQANCHMSA-N 0 1 337.427 1.757 50 70 EDIAMN Cc1cc(C[C@@H](C)NC(=O)Nc2ccnn2C[C@@H]2CCOC2)n[nH]1 ZINC000159598138 225247500 /nfs/dbraw/zinc/24/75/00/225247500.db2.gz YYEHRCISXRPLME-YPMHNXCESA-N 0 1 332.408 1.704 50 70 EDIAMN CC(=O)c1c(C)nn(CCC(=O)N2CCC[C@H]2c2n[nH]c(C)n2)c1C ZINC000218074318 241296657 /nfs/dbraw/zinc/29/66/57/241296657.db2.gz DRPIJUUCIRBKHX-AWEZNQCLSA-N 0 1 344.419 1.883 50 70 EDIAMN O=C(NCc1nc(Cc2ccccc2)no1)c1ccc2[nH]nnc2c1 ZINC000218128875 241300736 /nfs/dbraw/zinc/30/07/36/241300736.db2.gz IRKXIZNUQQTQHA-UHFFFAOYSA-N 0 1 334.339 1.862 50 70 EDIAMN CN(C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)Cc1nc2cc(Cl)ccc2[nH]1 ZINC000218312680 241313826 /nfs/dbraw/zinc/31/38/26/241313826.db2.gz MRDXQHQZDGTPLU-ITDAGMBRSA-N 0 1 348.834 1.593 50 70 EDIAMN Cn1ccnc1[C@@H](O)c1cc2n(n1)CCN(CCc1ccccc1)C2 ZINC000218571026 241333285 /nfs/dbraw/zinc/33/32/85/241333285.db2.gz LSBYPTIUWXUYAT-SFHVURJKSA-N 0 1 337.427 1.757 50 70 EDIAMN CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NCc1ccc2c(c1)CCCO2 ZINC000218182998 534567781 /nfs/dbraw/zinc/56/77/81/534567781.db2.gz OQVWUWCJHHRYPH-INIZCTEOSA-N 0 1 342.399 1.098 50 70 EDIAMN Cc1nc([C@@H]2CCCN2C(=O)C2(N3CCOCC3)CCCCC2)n[nH]1 ZINC000217143177 241237696 /nfs/dbraw/zinc/23/76/96/241237696.db2.gz SGVGNBUPIWSWBN-HNNXBMFYSA-N 0 1 347.463 1.812 50 70 EDIAMN OC[C@H](O)c1cc2n(n1)CCCN(CCn1cnc3ccccc31)C2 ZINC000217576383 443057407 /nfs/dbraw/zinc/05/74/07/443057407.db2.gz VOQHYBZXXDECBI-SFHVURJKSA-N 0 1 341.415 1.164 50 70 EDIAMN CCOc1ccc(C(=O)N[C@H]2[C@H]3CCO[C@H]3[C@@H]2N(C)C)cc1OCC ZINC000218023981 241292042 /nfs/dbraw/zinc/29/20/42/241292042.db2.gz CTQYFEJODCVFID-BVPBIZIASA-N 0 1 348.443 1.931 50 70 EDIAMN COCc1cc(CNC(=O)[C@H](c2ccc3c(c2)OCO3)N(C)C)n[nH]1 ZINC000218191793 241304160 /nfs/dbraw/zinc/30/41/60/241304160.db2.gz FHOYIWKNORBYIE-INIZCTEOSA-N 0 1 346.387 1.204 50 70 EDIAMN OC[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CCO1 ZINC000160064756 441856672 /nfs/dbraw/zinc/85/66/72/441856672.db2.gz WKPRXJKIMPCEME-SNVBAGLBSA-N 0 1 326.194 1.519 50 70 EDIAMN CN(C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)c1ccc(-n2ccnc2)cc1 ZINC000218263145 241311632 /nfs/dbraw/zinc/31/16/32/241311632.db2.gz LLIMBJSOTCTQME-YYIAUSFCSA-N 0 1 326.400 1.320 50 70 EDIAMN Cc1cc(C[C@@H](C)NC(=O)Nc2cnn(-c3ncccn3)c2)n[nH]1 ZINC000161100171 441956762 /nfs/dbraw/zinc/95/67/62/441956762.db2.gz UGQCXWHJIUIKEB-SNVBAGLBSA-N 0 1 326.364 1.447 50 70 EDIAMN O=C(CCN1CCCn2nc(CO)cc2C1)NC1CCCCCC1 ZINC000217653853 241264977 /nfs/dbraw/zinc/26/49/77/241264977.db2.gz WYQNLSVQDLRDBT-UHFFFAOYSA-N 0 1 334.464 1.810 50 70 EDIAMN OC[C@H](O)c1cc2n(n1)CCCN(Cc1cccc3cc[nH]c31)C2 ZINC000216980855 241231145 /nfs/dbraw/zinc/23/11/45/241231145.db2.gz DZRXSZYMRGLKML-KRWDZBQOSA-N 0 1 326.400 1.796 50 70 EDIAMN Cc1cc(C)nc(-n2cc(C(=O)N3CCNCC3)c(C(C)C)n2)n1 ZINC000159378238 534129519 /nfs/dbraw/zinc/12/95/19/534129519.db2.gz PQTAJPJVZZTODF-UHFFFAOYSA-N 0 1 328.420 1.448 50 70 EDIAMN Cc1nc([C@H]2CCCN2C(=O)CN2CCOc3ccccc3C2)n[nH]1 ZINC000217903174 293125755 /nfs/dbraw/zinc/12/57/55/293125755.db2.gz DWGRZEAFCYDQRF-OAHLLOKOSA-N 0 1 341.415 1.671 50 70 EDIAMN O=C(CCCOc1ccccc1)N1CCN(Cc2nnc[nH]2)CC1 ZINC000218062558 241296150 /nfs/dbraw/zinc/29/61/50/241296150.db2.gz PLEGTFNDIMHWME-UHFFFAOYSA-N 0 1 329.404 1.308 50 70 EDIAMN Cn1ccnc1[C@H](O)c1cc2n(n1)CCN(CCc1ccccc1)C2 ZINC000218571104 241333421 /nfs/dbraw/zinc/33/34/21/241333421.db2.gz LSBYPTIUWXUYAT-GOSISDBHSA-N 0 1 337.427 1.757 50 70 EDIAMN Cc1cc(N)n(CC(=O)N(C)Cc2nc3ccc(Cl)cc3[nH]2)n1 ZINC000217726109 241270839 /nfs/dbraw/zinc/27/08/39/241270839.db2.gz XBXBRLOBIVCMBU-UHFFFAOYSA-N 0 1 332.795 1.962 50 70 EDIAMN O=C(CCCN1Cc2ccccc2C1)NCCc1noc(CO)n1 ZINC000217427089 241248888 /nfs/dbraw/zinc/24/88/88/241248888.db2.gz FXVASJDYEGSSRE-UHFFFAOYSA-N 0 1 330.388 1.017 50 70 EDIAMN COc1ccc(CNc2cc(C3CC(O)C3)nc(N)n2)c(OC)c1 ZINC000218512068 241328516 /nfs/dbraw/zinc/32/85/16/241328516.db2.gz FEFMWTZQZULOHU-UHFFFAOYSA-N 0 1 330.388 1.926 50 70 EDIAMN CC(C)Cc1nc(NC(=O)Cn2cnc3sccc3c2=O)n[nH]1 ZINC000218366911 241318427 /nfs/dbraw/zinc/31/84/27/241318427.db2.gz ANXYNEYQTDJTOV-UHFFFAOYSA-N 0 1 332.389 1.413 50 70 EDIAMN CC(C)Cc1n[nH]c(NC(=O)Cn2cnc3sccc3c2=O)n1 ZINC000218366911 241318432 /nfs/dbraw/zinc/31/84/32/241318432.db2.gz ANXYNEYQTDJTOV-UHFFFAOYSA-N 0 1 332.389 1.413 50 70 EDIAMN CN(Cc1ccc2nonc2c1)c1cc(C2CC(O)C2)nc(N)n1 ZINC000218458600 536474147 /nfs/dbraw/zinc/47/41/47/536474147.db2.gz SUOLRMYEEAMNSW-UHFFFAOYSA-N 0 1 326.360 1.470 50 70 EDIAMN COc1ccc2nc(CCN(C)C(=O)CN3CCOC3=O)[nH]c2c1 ZINC000218430035 241321273 /nfs/dbraw/zinc/32/12/73/241321273.db2.gz SNWCCWXCRUEXQY-UHFFFAOYSA-N 0 1 332.360 1.025 50 70 EDIAMN O=C(NCCc1cnc[nH]1)C1CCN(c2ccc(Cl)nn2)CC1 ZINC000218428879 241321804 /nfs/dbraw/zinc/32/18/04/241321804.db2.gz ZECQWCJVJMVQBN-UHFFFAOYSA-N 0 1 334.811 1.428 50 70 EDIAMN Cn1ccnc1[C@H](O)c1cc2n(n1)CCN(CCCc1ccco1)C2 ZINC000218348138 241316107 /nfs/dbraw/zinc/31/61/07/241316107.db2.gz BJZKKGHIEWOATJ-QGZVFWFLSA-N 0 1 341.415 1.740 50 70 EDIAMN Cc1nc(C)c(CN2CCn3nc([C@H](O)CN(C)C)cc3C2)s1 ZINC000218697500 241338389 /nfs/dbraw/zinc/33/83/89/241338389.db2.gz QXPOOYHYBZYCAQ-OAHLLOKOSA-N 0 1 335.477 1.567 50 70 EDIAMN Cc1nc(=O)[nH]c(C)c1CCC(=O)N[C@H]1COC[C@@H]1N1CCCCC1 ZINC000218717036 241341727 /nfs/dbraw/zinc/34/17/27/241341727.db2.gz DCQVIMOQTFBUMZ-HOTGVXAUSA-N 0 1 348.447 1.101 50 70 EDIAMN CC(C)(O)CN1CCN(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)CC1 ZINC000160941669 206320291 /nfs/dbraw/zinc/32/02/91/206320291.db2.gz FJFNWDCOBAWBHJ-ZNMIVQPWSA-N 0 1 337.464 1.042 50 70 EDIAMN Cn1cccc1[C@H](O)CCNS(=O)(=O)c1c(F)cccc1F ZINC000217942080 241286359 /nfs/dbraw/zinc/28/63/59/241286359.db2.gz DDKFBKQTJOJFJH-CYBMUJFWSA-N 0 1 330.356 1.705 50 70 EDIAMN Cc1cc(C[C@H](C)NC(=O)Nc2ccnn2C[C@H]2CCOC2)n[nH]1 ZINC000159598547 206255076 /nfs/dbraw/zinc/25/50/76/206255076.db2.gz YYEHRCISXRPLME-WCQYABFASA-N 0 1 332.408 1.704 50 70 EDIAMN O=C(CN1CC[C@H](c2ccccc2)C1)NCc1cnn2cccnc12 ZINC000217175030 241237678 /nfs/dbraw/zinc/23/76/78/241237678.db2.gz HDTYDBNYVRKPOV-INIZCTEOSA-N 0 1 335.411 1.835 50 70 EDIAMN CC1CCN(Cc2ccc(C(=O)N(C)C[C@@H]3COCCO3)o2)CC1 ZINC000217812660 241276493 /nfs/dbraw/zinc/27/64/93/241276493.db2.gz WWVHVRCCVYNFAN-MRXNPFEDSA-N 0 1 336.432 1.999 50 70 EDIAMN Cc1cc(C)n(C[C@H]2CCCO2)c(=O)c1C(=O)NCCc1cnc[nH]1 ZINC000218488105 241327277 /nfs/dbraw/zinc/32/72/77/241327277.db2.gz AUQAFQZFQASAMG-OAHLLOKOSA-N 0 1 344.415 1.340 50 70 EDIAMN CC(=O)c1c(C)nn(CCC(=O)N2CCC[C@@H]2c2n[nH]c(C)n2)c1C ZINC000218074252 241295931 /nfs/dbraw/zinc/29/59/31/241295931.db2.gz DRPIJUUCIRBKHX-CQSZACIVSA-N 0 1 344.419 1.883 50 70 EDIAMN CN1CCCNC(=O)C12CCN(C(=O)c1ccc(Cl)s1)CC2 ZINC000217706227 241271215 /nfs/dbraw/zinc/27/12/15/241271215.db2.gz FYNCYDVKDFIMPN-UHFFFAOYSA-N 0 1 341.864 1.828 50 70 EDIAMN CN(C)[C@H]1[C@@H]2OCC[C@@H]2[C@@H]1NC(=O)c1c[nH]nc1-c1ccccc1F ZINC000218169449 241303353 /nfs/dbraw/zinc/30/33/53/241303353.db2.gz RREHWJVWAYZSIZ-GLZXHMCRSA-N 0 1 344.390 1.663 50 70 EDIAMN Cc1nc(CCN(C)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)no1 ZINC000218393916 241319031 /nfs/dbraw/zinc/31/90/31/241319031.db2.gz OIAWMVMERAOEMZ-AWEZNQCLSA-N 0 1 327.388 1.430 50 70 EDIAMN Cc1cc(C[C@H](C)NC(=O)Nc2ccnn2C[C@@H]2CCOC2)n[nH]1 ZINC000159598284 206254234 /nfs/dbraw/zinc/25/42/34/206254234.db2.gz YYEHRCISXRPLME-AAEUAGOBSA-N 0 1 332.408 1.704 50 70 EDIAMN O=C(NCCc1noc(CO)n1)[C@H]1CCCCN1Cc1ccccc1 ZINC000217620770 443057446 /nfs/dbraw/zinc/05/74/46/443057446.db2.gz KIBPLUKCNGXKJE-OAHLLOKOSA-N 0 1 344.415 1.275 50 70 EDIAMN COC[C@H]1[C@@H](NC(=O)c2c[nH]c3c(C)cccc3c2=O)[C@@H]2CCO[C@H]12 ZINC000218735233 536612695 /nfs/dbraw/zinc/61/26/95/536612695.db2.gz RMZZUIRKVLAGFG-GKEYINFOSA-N 0 1 342.395 1.616 50 70 EDIAMN O=C(c1ccncc1O)N1CCN(Cc2ccc(F)cc2)C(=O)C1 ZINC000217791669 241275130 /nfs/dbraw/zinc/27/51/30/241275130.db2.gz IEQBTILMGUJYBL-UHFFFAOYSA-N 0 1 329.331 1.411 50 70 EDIAMN Cc1nc(CCN(C)C(=O)CN2CC[C@H](c3ccccc3)C2)no1 ZINC000218424648 241322162 /nfs/dbraw/zinc/32/21/62/241322162.db2.gz QYBGYOIRVSFKJF-INIZCTEOSA-N 0 1 328.416 1.868 50 70 EDIAMN 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