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346866196 /nfs/dbraw/zinc/86/61/96/346866196.db2.gz BCEVSSNQUATMAU-UHFFFAOYSA-N 0 2 282.294 2.247 20 30 CEEDLN C[C@@H](CCc1cccc(F)c1)C(=O)N=c1[nH][nH]cc1C#N ZINC000601639084 346867132 /nfs/dbraw/zinc/86/71/32/346867132.db2.gz HJQBQFAOITXJKS-JTQLQIEISA-N 0 2 286.310 2.050 20 30 CEEDLN CC(C)[C@H](Cc1ccccc1)C(=O)N=c1[nH][nH]cc1C#N ZINC000601638568 346867223 /nfs/dbraw/zinc/86/72/23/346867223.db2.gz DQWPZZMHMKGAGT-AWEZNQCLSA-N 0 2 282.347 2.157 20 30 CEEDLN CCN(C[C@H](C)C#N)C(=O)c1cc(F)c(F)c(O)c1F ZINC000042449341 362096520 /nfs/dbraw/zinc/09/65/20/362096520.db2.gz TUFCOVRSMWSPLD-SSDOTTSWSA-N 0 2 286.253 2.431 20 30 CEEDLN N#Cc1nc(NC(=O)c2cc3c(cccc3F)[nH]2)[nH]c1C#N ZINC000045579454 362162322 /nfs/dbraw/zinc/16/23/22/362162322.db2.gz JJWWCDFGQXIZSV-UHFFFAOYSA-N 0 2 294.249 2.026 20 30 CEEDLN C[C@H](N1N=C(c2cccc(C#N)c2)CC1=O)C(F)(F)F ZINC000601949302 346940825 /nfs/dbraw/zinc/94/08/25/346940825.db2.gz HPKUGZYXBQGGLL-QMMMGPOBSA-N 0 2 281.237 2.445 20 30 CEEDLN 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296.315 2.052 20 30 CEEDLN Cc1csc(C(C#N)C(=O)CSc2ncco2)n1 ZINC000278080524 328223349 /nfs/dbraw/zinc/22/33/49/328223349.db2.gz XDEUFKJEPBRWPX-QMMMGPOBSA-N 0 2 279.346 2.408 20 30 CEEDLN Cc1csc([C@@H](C#N)C(=O)CSc2ncco2)n1 ZINC000278080524 328223350 /nfs/dbraw/zinc/22/33/50/328223350.db2.gz XDEUFKJEPBRWPX-QMMMGPOBSA-N 0 2 279.346 2.408 20 30 CEEDLN C=CCCCS(=O)(=O)Nc1cc(CCCC)[nH]n1 ZINC000291863993 328267179 /nfs/dbraw/zinc/26/71/79/328267179.db2.gz KJVOTUJPFCYXSD-UHFFFAOYSA-N 0 2 271.386 2.460 20 30 CEEDLN N#CC(=C([O-])c1cn2c([nH+]1)CCC2)c1nc2ccccc2o1 ZINC000582359396 328970338 /nfs/dbraw/zinc/97/03/38/328970338.db2.gz KTPPISTXQGQKKA-SNVBAGLBSA-N 0 2 292.298 2.461 20 30 CEEDLN CC(C)(C#N)C(=O)Nc1nc(-c2c(F)cccc2F)n[nH]1 ZINC000377943552 329035483 /nfs/dbraw/zinc/03/54/83/329035483.db2.gz JTDPOJNTEPYZIN-UHFFFAOYSA-N 0 2 291.261 2.238 20 30 CEEDLN CC#CCNC(=O)N=c1nc(-c2sccc2C)[nH]s1 ZINC000443367043 330798349 /nfs/dbraw/zinc/79/83/49/330798349.db2.gz HCMIKNBDJGCVKR-UHFFFAOYSA-N 0 2 292.389 2.142 20 30 CEEDLN C#CCN(C(=O)[C@H](F)C(F)(F)F)C1CCCC1 ZINC000491070382 332145641 /nfs/dbraw/zinc/14/56/41/332145641.db2.gz BHTUEEIZSXVAIT-VIFPVBQESA-N 0 2 251.223 2.291 20 30 CEEDLN C#CCN(C(=O)C(F)C(F)(F)F)C1CCCC1 ZINC000491070382 332145642 /nfs/dbraw/zinc/14/56/42/332145642.db2.gz BHTUEEIZSXVAIT-VIFPVBQESA-N 0 2 251.223 2.291 20 30 CEEDLN C#C[C@@H](C)N(C)C(=O)N=c1nc(-c2ccccc2)[nH]s1 ZINC000491734765 332315558 /nfs/dbraw/zinc/31/55/58/332315558.db2.gz OAOYYGVTMJBSCV-SNVBAGLBSA-N 0 2 286.360 2.112 20 30 CEEDLN Cn1cc[nH+]c1C([O-])=C(C#N)C(=O)[C@@H]1C[C@H]1c1ccsc1 ZINC000528967594 333466826 /nfs/dbraw/zinc/46/68/26/333466826.db2.gz BSFHFOQHPZQXMD-TUAOUCFPSA-N 0 2 299.355 2.177 20 30 CEEDLN N#C[C@@H](C(=O)c1csc(C2CC2)n1)c1ccncn1 ZINC000546859943 334052011 /nfs/dbraw/zinc/05/20/11/334052011.db2.gz UKJPIETUTDHYMC-SECBINFHSA-N 0 2 270.317 2.301 20 30 CEEDLN N#CC(C(=O)c1csc(C2CC2)n1)c1ccncn1 ZINC000546859943 334052012 /nfs/dbraw/zinc/05/20/12/334052012.db2.gz UKJPIETUTDHYMC-SECBINFHSA-N 0 2 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