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/nfs/dbraw/zinc/81/57/01/344815701.db2.gz QTMBFGCCUSDEAX-JTQLQIEISA-N 0 3 189.283 3.087 10 30 AGEEHN C=C(C)CN1Cc2ccccc2[C@@H]1C 621396752 347229510 /nfs/dbraw/zinc/22/95/10/347229510.db2.gz BEQVTXLTMUNHAF-NSHDSACASA-N 0 3 187.286 3.139 10 30 AGEEHN CC/C=N/C12CC3CC(CC(C3)C1)C2 4863265 342996532 /nfs/dbraw/zinc/99/65/32/342996532.db2.gz HKENMYWYWDFBTF-LZWSPWQCSA-N 0 3 191.318 3.436 10 30 AGEEHN CCC(C#N)C(=O)C1CCCCCC1 53714862 343315113 /nfs/dbraw/zinc/31/51/13/343315113.db2.gz SIJGDBKSXVHKHE-SNVBAGLBSA-N 0 3 193.290 3.076 10 30 AGEEHN CCC(C#N)C(=O)C1CCCCCC1 53714861 343315281 /nfs/dbraw/zinc/31/52/81/343315281.db2.gz SIJGDBKSXVHKHE-JTQLQIEISA-N 0 3 193.290 3.076 10 30 AGEEHN C=C(C)[C@H](N)c1coc2ccccc12 128679948 343835496 /nfs/dbraw/zinc/83/54/96/343835496.db2.gz WCVIPCCYXMTLQW-LBPRGKRZSA-N 0 3 187.242 3.009 10 30 AGEEHN C=C(C)[C@@H](N)c1coc2ccccc12 128680198 343835595 /nfs/dbraw/zinc/83/55/95/343835595.db2.gz WCVIPCCYXMTLQW-GFCCVEGCSA-N 0 3 187.242 3.009 10 30 AGEEHN C=C[C@@H](N)c1cc2sccc2s1 130712848 343873301 /nfs/dbraw/zinc/87/33/01/343873301.db2.gz JWDJEDGKVHFPSW-ZCFIWIBFSA-N 0 3 195.312 3.149 10 30 AGEEHN C=C[C@H](N)c1cc2sccc2s1 130712613 343873466 /nfs/dbraw/zinc/87/34/66/343873466.db2.gz JWDJEDGKVHFPSW-LURJTMIESA-N 0 3 195.312 3.149 10 30 AGEEHN C=C(C)[C@H](NC)c1cc(C)cc(C)c1 131273562 343883240 /nfs/dbraw/zinc/88/32/40/343883240.db2.gz IUIJFWWTNUAZAY-ZDUSSCGKSA-N 0 3 189.302 3.140 10 30 AGEEHN C=C(C)[C@@H](NC)c1cc(C)cc(C)c1 131273455 343883550 /nfs/dbraw/zinc/88/35/50/343883550.db2.gz IUIJFWWTNUAZAY-CYBMUJFWSA-N 0 3 189.302 3.140 10 30 AGEEHN C=C(C)[C@H](N)c1c(F)cccc1Cl 131339587 343883893 /nfs/dbraw/zinc/88/38/93/343883893.db2.gz SXTOYIQTYCDYLI-JTQLQIEISA-N 0 3 199.656 3.055 10 30 AGEEHN C=C(C)[C@H](N)c1cccc(F)c1Cl 131380273 343884442 /nfs/dbraw/zinc/88/44/42/343884442.db2.gz LPGROMDMVPJHIM-JTQLQIEISA-N 0 3 199.656 3.055 10 30 AGEEHN C=C(C)[C@@H](N)c1cc(Cl)ccc1C 131368227 343884534 /nfs/dbraw/zinc/88/45/34/343884534.db2.gz 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C=C(C)[C@@H](N)c1ccc(C)cc1Cl 232557051 344682370 /nfs/dbraw/zinc/68/23/70/344682370.db2.gz GYCGFAXWVQUNOH-LLVKDONJSA-N 0 3 195.693 3.224 10 30 AGEEHN C=C(C)[C@H](N)c1ccc(Cl)cc1C 232564637 344683254 /nfs/dbraw/zinc/68/32/54/344683254.db2.gz BAOIDIDJDFHESB-NSHDSACASA-N 0 3 195.693 3.224 10 30 AGEEHN C=C[C@H](NC)c1ccc(Cl)cc1C 234432070 344720499 /nfs/dbraw/zinc/72/04/99/344720499.db2.gz YLKFQFYUTHEXNC-NSHDSACASA-N 0 3 195.693 3.095 10 30 AGEEHN C=C[C@@H](NC)c1ccc(Cl)cc1C 234480534 344721571 /nfs/dbraw/zinc/72/15/71/344721571.db2.gz YLKFQFYUTHEXNC-LLVKDONJSA-N 0 3 195.693 3.095 10 30 AGEEHN C=C[C@@H](N)c1ccc2sccc2c1 238583023 344814309 /nfs/dbraw/zinc/81/43/09/344814309.db2.gz QTMBFGCCUSDEAX-SNVBAGLBSA-N 0 3 189.283 3.087 10 30 AGEEHN C=C(C)[C@H](N)c1cc(F)ccc1Cl 307723613 346203540 /nfs/dbraw/zinc/20/35/40/346203540.db2.gz VRUWDDYOQPCEAI-JTQLQIEISA-N 0 3 199.656 3.055 10 30 AGEEHN C=C(C)[C@@H](N)c1cc(F)ccc1Cl 307723614 346203563 /nfs/dbraw/zinc/20/35/63/346203563.db2.gz 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C=C(CC)CNCc1csc(C)c1 381147471 409878760 /nfs/dbraw/zinc/87/87/60/409878760.db2.gz KTRYSDCPVVASQS-UHFFFAOYSA-N 0 3 195.331 3.112 10 30 AGEEHN C=CCCCCN(C)Cc1ccoc1 649254578 410179818 /nfs/dbraw/zinc/17/98/18/410179818.db2.gz DYYCQEOQNCQIFV-UHFFFAOYSA-N 0 3 193.290 3.068 10 30 AGEEHN C=C1CCN(CC2=CCCCC2)CC1 649303457 410188154 /nfs/dbraw/zinc/18/81/54/410188154.db2.gz ZLDOMIMCUSPJTO-UHFFFAOYSA-N 0 3 191.318 3.139 10 30 AGEEHN C=CCCCCN1CC[C@@H](C)[C@H](F)C1 649416418 410195807 /nfs/dbraw/zinc/19/58/07/410195807.db2.gz WOUFGELSEBIJTE-VXGBXAGGSA-N 0 3 199.313 3.023 10 30 AGEEHN C=CCCCCN1CC[C@@H](C)[C@@H](F)C1 649416415 410196113 /nfs/dbraw/zinc/19/61/13/410196113.db2.gz WOUFGELSEBIJTE-NEPJUHHUSA-N 0 3 199.313 3.023 10 30 AGEEHN C=CCCCCN1CC[C@H](C)[C@H](F)C1 649416416 410197223 /nfs/dbraw/zinc/19/72/23/410197223.db2.gz WOUFGELSEBIJTE-NWDGAFQWSA-N 0 3 199.313 3.023 10 30 AGEEHN C=CCCCCN1CC[C@H](C)[C@@H](F)C1 649416417 410197564 /nfs/dbraw/zinc/19/75/64/410197564.db2.gz 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