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C#CCN(c1nnc(C(=O)N2CCCC2)n1C[C@H](C1CC1)N(C)C)[C@H]1CCS(=O)(=O)C1 ZINC001588024594 1072303810 /nfs/dbraw/zinc/30/38/10/1072303810.db2.gz HMRHQGZTJFFBLE-ZWKOTPCHSA-N 0 1 448.593 0.481 20 30 ICEDMN C#CCN(c1nnc(-c2ccccc2F)n1C[C@@]1(O)CCN(C)C1)[C@H]1CCS(=O)(=O)C1 ZINC001588046034 1072307504 /nfs/dbraw/zinc/30/75/04/1072307504.db2.gz WBVNHTNLPQYWGU-HRAATJIYSA-N 0 1 447.536 0.778 20 30 ICEDMN C#CCN(c1nnc(-c2ccccc2F)n1C[C@]1(O)CCN(C)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001588046035 1072307314 /nfs/dbraw/zinc/30/73/14/1072307314.db2.gz WBVNHTNLPQYWGU-IERDGZPVSA-N 0 1 447.536 0.778 20 30 ICEDMN C#CCN(c1nnc(-c2ccccc2F)n1C[C@@]1(O)CCN(C)C1)[C@@H]1CCS(=O)(=O)C1 ZINC001588046036 1072307281 /nfs/dbraw/zinc/30/72/81/1072307281.db2.gz WBVNHTNLPQYWGU-IIBYNOLFSA-N 0 1 447.536 0.778 20 30 ICEDMN C#CCN(c1nnc(-c2ccccc2F)n1C[C@]1(O)CCN(C)C1)[C@H]1CCS(=O)(=O)C1 ZINC001588046037 1072307383 /nfs/dbraw/zinc/30/73/83/1072307383.db2.gz WBVNHTNLPQYWGU-KKSFZXQISA-N 0 1 447.536 0.778 20 30 ICEDMN C#CCN(c1nnc(-c2cnn(C)c2)n1CCN1CCCCC1)[C@@H]1CCS(=O)(=O)C1 ZINC001588049974 1072308368 /nfs/dbraw/zinc/30/83/68/1072308368.db2.gz OOYSOTFPSVUQHD-GOSISDBHSA-N 0 1 431.566 0.791 20 30 ICEDMN C#CCN(c1nnc(-c2cnn(C)c2)n1CCN1CCCCC1)[C@H]1CCS(=O)(=O)C1 ZINC001588049975 1072308424 /nfs/dbraw/zinc/30/84/24/1072308424.db2.gz OOYSOTFPSVUQHD-SFHVURJKSA-N 0 1 431.566 0.791 20 30 ICEDMN C#CCN(c1nnc([C@H]2CCC(=O)N2)n1CCCN1CCCC1)[C@H]1CCS(=O)(=O)C1 ZINC001588053502 1072309316 /nfs/dbraw/zinc/30/93/16/1072309316.db2.gz FHDDYMLZKSOCLW-DLBZAZTESA-N 0 1 434.566 0.342 20 30 ICEDMN C#CCN(c1nnc([C@H]2CCC(=O)N2)n1CCCN1CCCC1)[C@@H]1CCS(=O)(=O)C1 ZINC001588053503 1072309257 /nfs/dbraw/zinc/30/92/57/1072309257.db2.gz FHDDYMLZKSOCLW-IAGOWNOFSA-N 0 1 434.566 0.342 20 30 ICEDMN C#CCN(c1nnc([C@@H]2CCC(=O)N2)n1CCCN1CCCC1)[C@H]1CCS(=O)(=O)C1 ZINC001588053505 1072309338 /nfs/dbraw/zinc/30/93/38/1072309338.db2.gz FHDDYMLZKSOCLW-IRXDYDNUSA-N 0 1 434.566 0.342 20 30 ICEDMN C#CCN(c1nnc([C@@H]2CCC(=O)N2)n1CCCN1CCCC1)[C@@H]1CCS(=O)(=O)C1 ZINC001588053506 1072309400 /nfs/dbraw/zinc/30/94/00/1072309400.db2.gz FHDDYMLZKSOCLW-SJORKVTESA-N 0 1 434.566 0.342 20 30 ICEDMN C#CCN(CC#C)c1nnc([C@H]2CCS(=O)(=O)C2)n1C[C@@H](C)CN1CCN(CC)CC1 ZINC001588140434 1072322149 /nfs/dbraw/zinc/32/21/49/1072322149.db2.gz XKHXYCLUKVKKNG-PMACEKPBSA-N 0 1 446.621 0.527 20 30 ICEDMN C#CCN(CC#C)c1nnc([C@H]2CCS(=O)(=O)C2)n1C[C@H](C)CN1CCN(CC)CC1 ZINC001588140435 1072322034 /nfs/dbraw/zinc/32/20/34/1072322034.db2.gz XKHXYCLUKVKKNG-UXHICEINSA-N 0 1 446.621 0.527 20 30 ICEDMN C#CCN(CC#C)c1nnc([C@@H]2CCS(=O)(=O)C2)n1C[C@@H](C)CN1CCN(CC)CC1 ZINC001588140436 1072322115 /nfs/dbraw/zinc/32/21/15/1072322115.db2.gz XKHXYCLUKVKKNG-VQTJNVASSA-N 0 1 446.621 0.527 20 30 ICEDMN C#CCN(CC#C)c1nnc([C@@H]2CCS(=O)(=O)C2)n1C[C@H](C)CN1CCN(CC)CC1 ZINC001588140437 1072322204 /nfs/dbraw/zinc/32/22/04/1072322204.db2.gz XKHXYCLUKVKKNG-WOJBJXKFSA-N 0 1 446.621 0.527 20 30 ICEDMN C#CCN(CC#C)c1nnc(CCN2CCN(c3ccccc3)CC2)n1CCC(=O)NC ZINC001588158689 1072323091 /nfs/dbraw/zinc/32/30/91/1072323091.db2.gz ISONGKLMIRZCLQ-UHFFFAOYSA-N 0 1 433.560 0.852 20 30 ICEDMN C#CCNS(=O)(=O)N1CCN(C(=O)c2cc(-c3ccc(OC)c(OC)c3)[nH]n2)CC1 ZINC001588198847 1072324478 /nfs/dbraw/zinc/32/44/78/1072324478.db2.gz ANQXMGWSHHGOKD-UHFFFAOYSA-N 0 1 433.490 0.319 20 30 ICEDMN C#CCN1CCN(c2nnc([C@H]3CCS(=O)(=O)C3)n2CCN2CCC[C@@H](C)C2)CC1 ZINC001588813778 1072341536 /nfs/dbraw/zinc/34/15/36/1072341536.db2.gz ZYNLYLSMHWOGOB-MOPGFXCFSA-N 0 1 434.610 0.667 20 30 ICEDMN C#CCN1CCN(c2nnc([C@H]3CCS(=O)(=O)C3)n2CCN2CCC[C@H](C)C2)CC1 ZINC001588813781 1072341729 /nfs/dbraw/zinc/34/17/29/1072341729.db2.gz ZYNLYLSMHWOGOB-OALUTQOASA-N 0 1 434.610 0.667 20 30 ICEDMN C#CCN1CCN(c2nnc([C@@H]3CCS(=O)(=O)C3)n2CCN2CCC[C@H](C)C2)CC1 ZINC001588813784 1072341763 /nfs/dbraw/zinc/34/17/63/1072341763.db2.gz ZYNLYLSMHWOGOB-RBUKOAKNSA-N 0 1 434.610 0.667 20 30 ICEDMN C#CCN1CCN(c2nnc([C@@H]3CCS(=O)(=O)C3)n2CCN2CCC[C@@H](C)C2)CC1 ZINC001588813786 1072341644 /nfs/dbraw/zinc/34/16/44/1072341644.db2.gz ZYNLYLSMHWOGOB-RTBURBONSA-N 0 1 434.610 0.667 20 30 ICEDMN C#CCN1CCN(c2nnc([C@@H]3CCS(=O)(=O)C3)n2C[C@@H]2CCCN2CCC)CC1 ZINC001588836898 1072342333 /nfs/dbraw/zinc/34/23/33/1072342333.db2.gz NYSHXXJMWXYSSG-MOPGFXCFSA-N 0 1 434.610 0.810 20 30 ICEDMN C#CCN1CCN(c2nnc([C@H]3CCS(=O)(=O)C3)n2C[C@@H]2CCCN2CCC)CC1 ZINC001588836901 1072342358 /nfs/dbraw/zinc/34/23/58/1072342358.db2.gz NYSHXXJMWXYSSG-OALUTQOASA-N 0 1 434.610 0.810 20 30 ICEDMN C=CCNS(=O)(=O)c1cccc(C(=O)N[C@H]2CCCN(CCN3CCOCC3)C2)c1 ZINC001588851793 1072342975 /nfs/dbraw/zinc/34/29/75/1072342975.db2.gz HUTWDSZOUFQZFZ-IBGZPJMESA-N 0 1 436.578 0.677 20 30 ICEDMN C=CCNS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCCN(CCN3CCOCC3)C2)c1 ZINC001588851794 1072342890 /nfs/dbraw/zinc/34/28/90/1072342890.db2.gz HUTWDSZOUFQZFZ-LJQANCHMSA-N 0 1 436.578 0.677 20 30 ICEDMN C#CCN1CCN(c2nnc(CN3CCCC3=O)n2C[C@@H]2CN(CC(C)C)CCO2)CC1 ZINC001588865636 1072345691 /nfs/dbraw/zinc/34/56/91/1072345691.db2.gz ZGEBMQHGYRNHGV-FQEVSTJZSA-N 0 1 443.596 0.513 20 30 ICEDMN C#CCN1CCN(c2nnc(CN3CCCC3=O)n2C[C@H]2CN(CC(C)C)CCO2)CC1 ZINC001588865637 1072345891 /nfs/dbraw/zinc/34/58/91/1072345891.db2.gz ZGEBMQHGYRNHGV-HXUWFJFHSA-N 0 1 443.596 0.513 20 30 ICEDMN C#CCNC(=O)C1CCN(c2nnc(C(=O)N3CCCC3)n2CCN(C)CCOC)CC1 ZINC001588884557 1072346519 /nfs/dbraw/zinc/34/65/19/1072346519.db2.gz FEFVRKPALLWBGX-UHFFFAOYSA-N 0 1 445.568 0.058 20 30 ICEDMN C#CCNC(=O)C1CCN(c2nnc([C@@H]3CCC(=O)N3)n2CCN2CCSCC2)CC1 ZINC001588923772 1072347857 /nfs/dbraw/zinc/34/78/57/1072347857.db2.gz LULGJGLMPFLMCR-KRWDZBQOSA-N 0 1 445.593 0.244 20 30 ICEDMN C#CCNC(=O)C1CCN(c2nnc([C@H]3CCC(=O)N3)n2CCN2CCSCC2)CC1 ZINC001588923773 1072347923 /nfs/dbraw/zinc/34/79/23/1072347923.db2.gz LULGJGLMPFLMCR-QGZVFWFLSA-N 0 1 445.593 0.244 20 30 ICEDMN C#CCNC(=O)C1CCN(c2nnc([C@@H]3CCS(=O)(=O)C3)n2C[C@H](C)N(C)C)CC1 ZINC001588929493 1072348341 /nfs/dbraw/zinc/34/83/41/1072348341.db2.gz BGIUVERDSJCNSD-DOTOQJQBSA-N 0 1 436.582 0.096 20 30 ICEDMN C#CCNC(=O)C1CCN(c2nnc([C@@H]3CCS(=O)(=O)C3)n2C[C@@H](C)N(C)C)CC1 ZINC001588929494 1072348311 /nfs/dbraw/zinc/34/83/11/1072348311.db2.gz BGIUVERDSJCNSD-NVXWUHKLSA-N 0 1 436.582 0.096 20 30 ICEDMN C#CCNC(=O)C1CCN(c2nnc([C@H]3CCS(=O)(=O)C3)n2C[C@H](C)N(C)C)CC1 ZINC001588929495 1072348434 /nfs/dbraw/zinc/34/84/34/1072348434.db2.gz BGIUVERDSJCNSD-RDJZCZTQSA-N 0 1 436.582 0.096 20 30 ICEDMN C#CCNC(=O)C1CCN(c2nnc([C@H]3CCS(=O)(=O)C3)n2C[C@@H](C)N(C)C)CC1 ZINC001588929496 1072348393 /nfs/dbraw/zinc/34/83/93/1072348393.db2.gz BGIUVERDSJCNSD-WBVHZDCISA-N 0 1 436.582 0.096 20 30 ICEDMN C#C[C@]1(C)CCCN1c1nnc([C@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nnc(C)[nH]1 ZINC001589216739 1072353935 /nfs/dbraw/zinc/35/39/35/1072353935.db2.gz WIXBMNKMUVVKSS-DNVCBOLYSA-N 0 1 448.553 0.272 20 30 ICEDMN C#C[C@]1(C)CCCN1c1nnc([C@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nc(C)n[nH]1 ZINC001589216739 1072353931 /nfs/dbraw/zinc/35/39/31/1072353931.db2.gz WIXBMNKMUVVKSS-DNVCBOLYSA-N 0 1 448.553 0.272 20 30 ICEDMN C#C[C@]1(C)CCCN1c1nnc([C@@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nnc(C)[nH]1 ZINC001589216740 1072353993 /nfs/dbraw/zinc/35/39/93/1072353993.db2.gz WIXBMNKMUVVKSS-HNAYVOBHSA-N 0 1 448.553 0.272 20 30 ICEDMN C#C[C@]1(C)CCCN1c1nnc([C@@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nc(C)n[nH]1 ZINC001589216740 1072353987 /nfs/dbraw/zinc/35/39/87/1072353987.db2.gz WIXBMNKMUVVKSS-HNAYVOBHSA-N 0 1 448.553 0.272 20 30 ICEDMN C=CCN(c1nnc([C@@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nnc(C)[nH]1)C1CC1 ZINC001595058154 1072380641 /nfs/dbraw/zinc/38/06/41/1072380641.db2.gz CBVNVUMEESFVOH-HNNXBMFYSA-N 0 1 436.542 0.435 20 30 ICEDMN C=CCN(c1nnc([C@@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nc(C)n[nH]1)C1CC1 ZINC001595058154 1072380637 /nfs/dbraw/zinc/38/06/37/1072380637.db2.gz CBVNVUMEESFVOH-HNNXBMFYSA-N 0 1 436.542 0.435 20 30 ICEDMN C=CCN(c1nnc([C@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nnc(C)[nH]1)C1CC1 ZINC001595058155 1072380579 /nfs/dbraw/zinc/38/05/79/1072380579.db2.gz CBVNVUMEESFVOH-OAHLLOKOSA-N 0 1 436.542 0.435 20 30 ICEDMN C=CCN(c1nnc([C@H]2CN(S(C)(=O)=O)CCO2)n1CCc1nc(C)n[nH]1)C1CC1 ZINC001595058155 1072380569 /nfs/dbraw/zinc/38/05/69/1072380569.db2.gz CBVNVUMEESFVOH-OAHLLOKOSA-N 0 1 436.542 0.435 20 30 ICEDMN C=CCNC(=O)Cn1c(C(=O)N2CCCC2)nnc1N1CC[C@@H](N2CCN(CC)CC2)C1 ZINC001595466174 1072387987 /nfs/dbraw/zinc/38/79/87/1072387987.db2.gz FXAPWIGUJBXPCU-GOSISDBHSA-N 0 1 444.584 0.033 20 30 ICEDMN C=CCNC(=O)Cn1c(C(=O)N2CCCC2)nnc1N1CC[C@H](N2CCN(CC)CC2)C1 ZINC001595466176 1072388105 /nfs/dbraw/zinc/38/81/05/1072388105.db2.gz FXAPWIGUJBXPCU-SFHVURJKSA-N 0 1 444.584 0.033 20 30 ICEDMN CCOC(=O)CON=C(C(=O)NCCN1Cc2ccccc2OCC1=O)c1ccn[nH]1 ZINC001595512249 1072392303 /nfs/dbraw/zinc/39/23/03/1072392303.db2.gz RTWGHSOBVWBVKP-UHFFFAOYSA-N 0 1 429.433 0.231 20 30 ICEDMN C=CCNC(=O)Cn1c(C2CC2)nnc1N1CCN(C[C@H]2CN(C(C)C)CCO2)CC1 ZINC001595536479 1072393616 /nfs/dbraw/zinc/39/36/16/1072393616.db2.gz 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