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/nfs/dbraw/zinc/57/23/00/484572300.db2.gz LHCXYZHZHITCPT-YPMHNXCESA-N -1 3 365.477 -0.304 20 30 FBEDHM N#CC1(CNS(=O)(=O)CCCS(=O)(=O)[N-]c2ccnnc2)CC1 ZINC000349569494 484568474 /nfs/dbraw/zinc/56/84/74/484568474.db2.gz HUCIPOIPYUQLBU-UHFFFAOYSA-N -1 3 359.433 -0.168 20 30 FBEDHM CC1(C)C[C@@]1(C#N)[N-]S(=O)(=O)CCCS(=O)(=O)N[C@H]1CCOC1 ZINC000349573338 484568221 /nfs/dbraw/zinc/56/82/21/484568221.db2.gz LHCXYZHZHITCPT-AAEUAGOBSA-N -1 3 365.477 -0.304 20 30 FBEDHM CC1(C)C[C@]1(C#N)[N-]S(=O)(=O)CCCS(=O)(=O)N[C@H]1CCOC1 ZINC000349573339 484567714 /nfs/dbraw/zinc/56/77/14/484567714.db2.gz LHCXYZHZHITCPT-WCQYABFASA-N -1 3 365.477 -0.304 20 30 FBEDHM Cc1ncc([N-]S(=O)(=O)CCCS(=O)(=O)NC[C@@H](C)C#N)cn1 ZINC000349579042 484183730 /nfs/dbraw/zinc/18/37/30/484183730.db2.gz XTOOMHXCQCLIGJ-JTQLQIEISA-N -1 3 361.449 -0.004 20 30 FBEDHM Cc1ncc([N-]S(=O)(=O)CCCS(=O)(=O)NC[C@H](C)C#N)cn1 ZINC000349579043 484182471 /nfs/dbraw/zinc/18/24/71/484182471.db2.gz XTOOMHXCQCLIGJ-SNVBAGLBSA-N -1 3 361.449 -0.004 20 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245060090 /nfs/dbraw/zinc/06/00/90/245060090.db2.gz QVTXUUBCFMYLTL-UHFFFAOYSA-N -1 3 355.354 -0.719 20 30 FBEDHM C=CCN1C(=O)C(=O)N(CC(=O)Nc2ccc(-c3nn[n-]n3)cc2)C1=O ZINC000363021255 483913508 /nfs/dbraw/zinc/91/35/08/483913508.db2.gz IYVYBHWLMGZOSA-UHFFFAOYSA-N -1 3 355.314 -0.218 20 30 FBEDHM C=CCN1C(=O)C(=O)N(CC(=O)Nc2ccc(-c3nnn[n-]3)cc2)C1=O ZINC000363021255 483913505 /nfs/dbraw/zinc/91/35/05/483913505.db2.gz IYVYBHWLMGZOSA-UHFFFAOYSA-N -1 3 355.314 -0.218 20 30 FBEDHM O=C(CCC/N=C1/[N-]S(=O)(=O)c2ccccc21)N1C[C@H](O)C[C@H]1CO ZINC000364330461 483538121 /nfs/dbraw/zinc/53/81/21/483538121.db2.gz YHTDQKRXBRUGNQ-NWDGAFQWSA-N -1 3 367.427 -0.541 20 30 FBEDHM C[C@H](/N=C1/[N-]S(=O)(=O)c2ccccc21)C(=O)N1C[C@H](O)C[C@H]1CO ZINC000364330510 483538405 /nfs/dbraw/zinc/53/84/05/483538405.db2.gz YURWEDYXHARMRF-GARJFASQSA-N -1 3 353.400 -0.932 20 30 FBEDHM N#Cc1ccc(CN2CC[C@@H](NC(=O)CN3CC(=O)[N-]C3=O)C2=O)cc1 ZINC000365178358 245216882 /nfs/dbraw/zinc/21/68/82/245216882.db2.gz 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C[C@H](/N=C1/[N-]S(=O)(=O)c2ccccc21)C(=O)N1CCCN(C)C(=O)C1 ZINC000369030544 483929842 /nfs/dbraw/zinc/92/98/42/483929842.db2.gz LDTKWBCFAWZLIM-NSHDSACASA-N -1 3 364.427 -0.196 20 30 FBEDHM CCN(C[C@H](C)C#N)S(=O)(=O)[N-][C@H]1CCN(c2ccn(C)n2)C1=O ZINC000369121797 483934908 /nfs/dbraw/zinc/93/49/08/483934908.db2.gz JYXORHCWCNBLAF-NEPJUHHUSA-N -1 3 354.436 -0.159 20 30 FBEDHM CCN(C[C@@H](C)C#N)S(=O)(=O)[N-][C@@H]1CCN(c2ccn(C)n2)C1=O ZINC000369121798 483933949 /nfs/dbraw/zinc/93/39/49/483933949.db2.gz JYXORHCWCNBLAF-NWDGAFQWSA-N -1 3 354.436 -0.159 20 30 FBEDHM CCN(C[C@@H](C)C#N)S(=O)(=O)[N-][C@H]1CCN(c2ccn(C)n2)C1=O ZINC000369121799 483934049 /nfs/dbraw/zinc/93/40/49/483934049.db2.gz JYXORHCWCNBLAF-RYUDHWBXSA-N -1 3 354.436 -0.159 20 30 FBEDHM CCN(C[C@H](C)C#N)S(=O)(=O)[N-][C@@H]1CCN(c2ccn(C)n2)C1=O ZINC000369121800 483934179 /nfs/dbraw/zinc/93/41/79/483934179.db2.gz JYXORHCWCNBLAF-VXGBXAGGSA-N -1 3 354.436 -0.159 20 30 FBEDHM COCCN(CCC#N)S(=O)(=O)[N-][C@@H]1CCN(c2ccn(C)n2)C1=O ZINC000369121930 483934296 /nfs/dbraw/zinc/93/42/96/483934296.db2.gz LKOHDQGAGYSCSV-GFCCVEGCSA-N -1 3 370.435 -0.778 20 30 FBEDHM COCCN(CCC#N)S(=O)(=O)[N-][C@H]1CCN(c2ccn(C)n2)C1=O ZINC000369121931 483934166 /nfs/dbraw/zinc/93/41/66/483934166.db2.gz LKOHDQGAGYSCSV-LBPRGKRZSA-N -1 3 370.435 -0.778 20 30 FBEDHM COC[C@H]1CN(C(=O)C/N=C2/[N-]S(=O)(=O)c3ccccc32)CCO1 ZINC000369631566 483972601 /nfs/dbraw/zinc/97/26/01/483972601.db2.gz ZJADXEVCNXJTLS-LLVKDONJSA-N -1 3 353.400 -0.401 20 30 FBEDHM COC[C@@H]1CN(C(=O)C/N=C2/[N-]S(=O)(=O)c3ccccc32)CCO1 ZINC000369631569 483973028 /nfs/dbraw/zinc/97/30/28/483973028.db2.gz ZJADXEVCNXJTLS-NSHDSACASA-N -1 3 353.400 -0.401 20 30 FBEDHM O=C(C/N=C1/[N-]S(=O)(=O)c2ccccc21)N1CC(F)(F)C[C@@H]1CO ZINC000370397086 484023270 /nfs/dbraw/zinc/02/32/70/484023270.db2.gz CYDDTPADJJBYRU-SECBINFHSA-N -1 3 359.354 -0.046 20 30 FBEDHM O=C(C/N=C1/[N-]S(=O)(=O)c2ccccc21)N1CC(F)(F)C[C@H]1CO ZINC000370397087 484024085 /nfs/dbraw/zinc/02/40/85/484024085.db2.gz CYDDTPADJJBYRU-VIFPVBQESA-N -1 3 359.354 -0.046 20 30 FBEDHM O=C(C/N=C1/[N-]S(=O)(=O)c2ccccc21)N1CCN2C(=O)OC[C@@H]2C1 ZINC000370548372 484033022 /nfs/dbraw/zinc/03/30/22/484033022.db2.gz KDRLSKZWNOWTQE-JTQLQIEISA-N -1 3 364.383 -0.612 20 30 FBEDHM O=C(C/N=C1/[N-]S(=O)(=O)c2ccccc21)N1CCN2C(=O)OC[C@H]2C1 ZINC000370548381 484033520 /nfs/dbraw/zinc/03/35/20/484033520.db2.gz KDRLSKZWNOWTQE-SNVBAGLBSA-N -1 3 364.383 -0.612 20 30 FBEDHM N#C[C@@H]1CN(C(=O)C/N=C2/[N-]S(=O)(=O)c3ccccc32)CCN1C1CC1 ZINC000370979989 483867286 /nfs/dbraw/zinc/86/72/86/483867286.db2.gz RISJCEQIIJPDNS-CYBMUJFWSA-N -1 3 373.438 -0.076 20 30 FBEDHM N#C[C@H]1CN(C(=O)C/N=C2/[N-]S(=O)(=O)c3ccccc32)CCN1C1CC1 ZINC000370979990 483867384 /nfs/dbraw/zinc/86/73/84/483867384.db2.gz RISJCEQIIJPDNS-ZDUSSCGKSA-N -1 3 373.438 -0.076 20 30 FBEDHM C[C@H]1CC(=O)NCCN1C(=O)C/N=C1/[N-]S(=O)(=O)c2ccccc21 ZINC000371012717 484097736 /nfs/dbraw/zinc/09/77/36/484097736.db2.gz ZEGCCNRTXJPCHG-JTQLQIEISA-N -1 3 350.400 -0.538 20 30 FBEDHM C[C@@H]1CC(=O)NCCN1C(=O)C/N=C1/[N-]S(=O)(=O)c2ccccc21 ZINC000371012718 484097484 /nfs/dbraw/zinc/09/74/84/484097484.db2.gz ZEGCCNRTXJPCHG-SNVBAGLBSA-N -1 3 350.400 -0.538 20 30 FBEDHM O=C(CCC/N=C1/[N-]S(=O)(=O)c2ccccc21)N1C[C@H](O)C[C@@H]1CO ZINC000371516562 484081109 /nfs/dbraw/zinc/08/11/09/484081109.db2.gz YHTDQKRXBRUGNQ-VXGBXAGGSA-N -1 3 367.427 -0.541 20 30 FBEDHM C=CC[N-]S(=O)(=O)c1cc(C(=O)N2C[C@@H](O)C[C@@H]2CO)ccc1F ZINC000371524709 484083579 /nfs/dbraw/zinc/08/35/79/484083579.db2.gz JPGGEYPTVCKBAR-NEPJUHHUSA-N -1 3 358.391 -0.142 20 30 FBEDHM C=CC[N-]S(=O)(=O)c1cc(C(=O)N2C[C@H](O)C[C@H]2CO)ccc1F ZINC000371524710 484083760 /nfs/dbraw/zinc/08/37/60/484083760.db2.gz JPGGEYPTVCKBAR-NWDGAFQWSA-N -1 3 358.391 -0.142 20 30 FBEDHM C=CC[N-]S(=O)(=O)c1cc(C(=O)N2C[C@H](O)C[C@@H]2CO)ccc1F ZINC000371524711 484083112 /nfs/dbraw/zinc/08/31/12/484083112.db2.gz JPGGEYPTVCKBAR-VXGBXAGGSA-N -1 3 358.391 -0.142 20 30 FBEDHM O=C(C/N=C1/[N-]S(=O)(=O)c2ccccc21)N1CCN2CCOC[C@H]2C1 ZINC000371870387 484110407 /nfs/dbraw/zinc/11/04/07/484110407.db2.gz PUKRYXTZHOJJBH-GFCCVEGCSA-N -1 3 364.427 -0.732 20 30 FBEDHM O=C(C/N=C1/[N-]S(=O)(=O)c2ccccc21)N1CCN2CCOC[C@@H]2C1 ZINC000371870388 484110509 /nfs/dbraw/zinc/11/05/09/484110509.db2.gz PUKRYXTZHOJJBH-LBPRGKRZSA-N -1 3 364.427 -0.732 20 30 FBEDHM CN1C(=O)N[C@]2(CCC[C@@H]2C[N-]S(=O)(=O)c2cccnc2C#N)C1=O ZINC000373787101 484780663 /nfs/dbraw/zinc/78/06/63/484780663.db2.gz LTIKOZPORKUPNA-BMIGLBTASA-N -1 3 363.399 -0.048 20 30 FBEDHM CN1C(=O)N[C@]2(CCC[C@H]2C[N-]S(=O)(=O)c2cccnc2C#N)C1=O ZINC000373787102 484780989 /nfs/dbraw/zinc/78/09/89/484780989.db2.gz LTIKOZPORKUPNA-BONVTDFDSA-N -1 3 363.399 -0.048 20 30 FBEDHM CN1C(=O)N[C@@]2(CCC[C@@H]2C[N-]S(=O)(=O)c2cccnc2C#N)C1=O ZINC000373787103 484780881 /nfs/dbraw/zinc/78/08/81/484780881.db2.gz LTIKOZPORKUPNA-MEBBXXQBSA-N -1 3 363.399 -0.048 20 30 FBEDHM CN1C(=O)N[C@@]2(CCC[C@H]2C[N-]S(=O)(=O)c2cccnc2C#N)C1=O ZINC000373787107 484780893 /nfs/dbraw/zinc/78/08/93/484780893.db2.gz 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/nfs/dbraw/zinc/07/38/73/661073873.db2.gz GFQCOSIPXZPSPA-RTXFEEFZSA-N -1 3 371.415 -0.871 20 30 FBEDHM Cc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@@H]2CCN([O-])C2=O)[C@H](C)O)cc1 ZINC000820179102 661073921 /nfs/dbraw/zinc/07/39/21/661073921.db2.gz GFQCOSIPXZPSPA-UHTWSYAYSA-N -1 3 371.415 -0.871 20 30 FBEDHM Cc1ccc(S(=O)(=O)N[C@H](C(=O)N[C@H]2CCN([O-])C2=O)[C@@H](C)O)cc1 ZINC000820179103 661073849 /nfs/dbraw/zinc/07/38/49/661073849.db2.gz GFQCOSIPXZPSPA-WXHSDQCUSA-N -1 3 371.415 -0.871 20 30 FBEDHM NC(=O)c1ccc(SCC(=O)N[C@@H]2CCN([O-])C2=O)c([N+](=O)[O-])c1 ZINC000820185110 661073896 /nfs/dbraw/zinc/07/38/96/661073896.db2.gz IFCJUKMOYQRHFR-MRVPVSSYSA-N -1 3 354.344 -0.108 20 30 FBEDHM NC(=O)c1ccc(SCC(=O)N[C@H]2CCN([O-])C2=O)c([N+](=O)[O-])c1 ZINC000820185112 661073815 /nfs/dbraw/zinc/07/38/15/661073815.db2.gz IFCJUKMOYQRHFR-QMMMGPOBSA-N -1 3 354.344 -0.108 20 30 FBEDHM O=C(C[N-]S(=O)(=O)c1ccc(Cl)s1)N[C@H]1CCN(O)C1=O ZINC000820186126 661073963 /nfs/dbraw/zinc/07/39/63/661073963.db2.gz 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C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N[C@@H](C)CC#N ZINC000820219867 607016716 /nfs/dbraw/zinc/01/67/16/607016716.db2.gz KOTLYMALRPEZMX-VHSXEESVSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N[C@@H](C)CC#N ZINC000820219867 607016715 /nfs/dbraw/zinc/01/67/15/607016715.db2.gz KOTLYMALRPEZMX-VHSXEESVSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@H](CC#N)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1 ZINC000820219868 607016276 /nfs/dbraw/zinc/01/62/76/607016276.db2.gz KOTLYMALRPEZMX-ZJUUUORDSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@H](CC#N)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1 ZINC000820219868 607016274 /nfs/dbraw/zinc/01/62/74/607016274.db2.gz KOTLYMALRPEZMX-ZJUUUORDSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@H](CC#N)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820220598 607016561 /nfs/dbraw/zinc/01/65/61/607016561.db2.gz WVODSNQRZAXCDH-NXEZZACHSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@H](CC#N)NC(=O)[C@@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820220598 607016559 /nfs/dbraw/zinc/01/65/59/607016559.db2.gz WVODSNQRZAXCDH-NXEZZACHSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@@H](CC#N)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820220601 607016347 /nfs/dbraw/zinc/01/63/47/607016347.db2.gz WVODSNQRZAXCDH-UWVGGRQHSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@@H](CC#N)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820220601 607016344 /nfs/dbraw/zinc/01/63/44/607016344.db2.gz WVODSNQRZAXCDH-UWVGGRQHSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N[C@@H](C)CC#N ZINC000820220604 607016612 /nfs/dbraw/zinc/01/66/12/607016612.db2.gz WVODSNQRZAXCDH-VHSXEESVSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N[C@@H](C)CC#N ZINC000820220604 607016610 /nfs/dbraw/zinc/01/66/10/607016610.db2.gz WVODSNQRZAXCDH-VHSXEESVSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@H](CC#N)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1 ZINC000820220606 607016290 /nfs/dbraw/zinc/01/62/90/607016290.db2.gz WVODSNQRZAXCDH-ZJUUUORDSA-N -1 3 363.403 -0.048 20 30 FBEDHM C[C@H](CC#N)NC(=O)[C@H](C)NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1 ZINC000820220606 607016289 /nfs/dbraw/zinc/01/62/89/607016289.db2.gz WVODSNQRZAXCDH-ZJUUUORDSA-N -1 3 363.403 -0.048 20 30 FBEDHM CN(C(=O)C/N=C1/[N-]S(=O)(=O)c2ccccc21)[C@@H]1CCC(=O)N(C)C1 ZINC000820403529 661075899 /nfs/dbraw/zinc/07/58/99/661075899.db2.gz VMPBFABHCZHWNX-LLVKDONJSA-N -1 3 364.427 -0.196 20 30 FBEDHM CN(C(=O)C/N=C1/[N-]S(=O)(=O)c2ccccc21)[C@H]1CCC(=O)N(C)C1 ZINC000820403531 661075950 /nfs/dbraw/zinc/07/59/50/661075950.db2.gz VMPBFABHCZHWNX-NSHDSACASA-N -1 3 364.427 -0.196 20 30 FBEDHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(CC#N)CC#N ZINC000820437850 607016676 /nfs/dbraw/zinc/01/66/76/607016676.db2.gz DYRUQLNAXOYKCP-JTQLQIEISA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(CC#N)CC#N ZINC000820437850 607016675 /nfs/dbraw/zinc/01/66/75/607016675.db2.gz DYRUQLNAXOYKCP-JTQLQIEISA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(CC#N)CC#N ZINC000820437851 607016629 /nfs/dbraw/zinc/01/66/29/607016629.db2.gz DYRUQLNAXOYKCP-SNVBAGLBSA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(CC#N)CC#N ZINC000820437851 607016627 /nfs/dbraw/zinc/01/66/27/607016627.db2.gz DYRUQLNAXOYKCP-SNVBAGLBSA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1(C#N)CC1 ZINC000820438142 607034819 /nfs/dbraw/zinc/03/48/19/607034819.db2.gz JEGLMHJAQODTCV-SECBINFHSA-N -1 3 361.387 -0.294 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1(C#N)CC1 ZINC000820438142 607034818 /nfs/dbraw/zinc/03/48/18/607034818.db2.gz JEGLMHJAQODTCV-SECBINFHSA-N -1 3 361.387 -0.294 20 30 FBEDHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)NC1(C#N)CC1 ZINC000820438143 607034960 /nfs/dbraw/zinc/03/49/60/607034960.db2.gz JEGLMHJAQODTCV-VIFPVBQESA-N -1 3 361.387 -0.294 20 30 FBEDHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)NC1(C#N)CC1 ZINC000820438143 607034958 /nfs/dbraw/zinc/03/49/58/607034958.db2.gz JEGLMHJAQODTCV-VIFPVBQESA-N -1 3 361.387 -0.294 20 30 FBEDHM C[C@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)CCC#N ZINC000820438414 607000157 /nfs/dbraw/zinc/00/01/57/607000157.db2.gz OXKXAGHXJCCCFL-JTQLQIEISA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)CCC#N ZINC000820438414 607000156 /nfs/dbraw/zinc/00/01/56/607000156.db2.gz OXKXAGHXJCCCFL-JTQLQIEISA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1ccc(-c2nn[n-]n2)cc1)C(=O)N(C)CCC#N ZINC000820438415 607000099 /nfs/dbraw/zinc/00/00/99/607000099.db2.gz OXKXAGHXJCCCFL-SNVBAGLBSA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1ccc(-c2nnn[n-]2)cc1)C(=O)N(C)CCC#N ZINC000820438415 607000097 /nfs/dbraw/zinc/00/00/97/607000097.db2.gz OXKXAGHXJCCCFL-SNVBAGLBSA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(CC#N)CC#N ZINC000820444011 607016442 /nfs/dbraw/zinc/01/64/42/607016442.db2.gz DHLCEKPYFWMBOP-JTQLQIEISA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(CC#N)CC#N ZINC000820444011 607016440 /nfs/dbraw/zinc/01/64/40/607016440.db2.gz DHLCEKPYFWMBOP-JTQLQIEISA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(CC#N)CC#N ZINC000820444012 607017284 /nfs/dbraw/zinc/01/72/84/607017284.db2.gz DHLCEKPYFWMBOP-SNVBAGLBSA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(CC#N)CC#N ZINC000820444012 607017283 /nfs/dbraw/zinc/01/72/83/607017283.db2.gz DHLCEKPYFWMBOP-SNVBAGLBSA-N -1 3 374.386 -0.591 20 30 FBEDHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)CCC#N ZINC000820444849 606999949 /nfs/dbraw/zinc/99/99/49/606999949.db2.gz MJRIXXBEPJAKBP-JTQLQIEISA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)CCC#N ZINC000820444849 606999947 /nfs/dbraw/zinc/99/99/47/606999947.db2.gz MJRIXXBEPJAKBP-JTQLQIEISA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)N(C)CCC#N ZINC000820444850 607000191 /nfs/dbraw/zinc/00/01/91/607000191.db2.gz MJRIXXBEPJAKBP-SNVBAGLBSA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)N(C)CCC#N ZINC000820444850 607000190 /nfs/dbraw/zinc/00/01/90/607000190.db2.gz MJRIXXBEPJAKBP-SNVBAGLBSA-N -1 3 363.403 -0.094 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC1(C#N)CC1 ZINC000820446596 607034816 /nfs/dbraw/zinc/03/48/16/607034816.db2.gz WGLSFNJVUPNDEX-SECBINFHSA-N -1 3 361.387 -0.294 20 30 FBEDHM C[C@@H](NS(=O)(=O)c1cccc(-c2nnn[n-]2)c1)C(=O)NC1(C#N)CC1 ZINC000820446596 607034815 /nfs/dbraw/zinc/03/48/15/607034815.db2.gz WGLSFNJVUPNDEX-SECBINFHSA-N -1 3 361.387 -0.294 20 30 FBEDHM C[C@H](NS(=O)(=O)c1cccc(-c2nn[n-]n2)c1)C(=O)NC1(C#N)CC1 ZINC000820446597 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