smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCCCCC(=O)O[C@H](CO)CO[P@@](=O)([O-])O ZINC000040165178 571759207 /nfs/dbraw/zinc/75/92/07/571759207.db2.gz LPQBQFLKBCPNAV-GOSISDBHSA-N -1 2 410.488 4.481 10 30 endogenous,in-man HIEELM CCCCCCCCCCCCCCCC(=O)O[C@H](CO)CO[P@](=O)([O-])O ZINC000040165178 571759212 /nfs/dbraw/zinc/75/92/12/571759212.db2.gz LPQBQFLKBCPNAV-GOSISDBHSA-N -1 2 410.488 4.481 10 30 endogenous,in-man HIEELM CCCCCCCC(=O)OC[C@@H](CO[P@@](=O)([O-])O)OC(=O)CCCCCCC ZINC000036178999 541108514 /nfs/dbraw/zinc/10/85/14/541108514.db2.gz XYSBQYUENLDGMI-KRWDZBQOSA-N -1 2 424.471 4.272 10 30 HIEELM CCCCCCCC(=O)OC[C@@H](CO[P@](=O)([O-])O)OC(=O)CCCCCCC ZINC000036178999 541108518 /nfs/dbraw/zinc/10/85/18/541108518.db2.gz XYSBQYUENLDGMI-KRWDZBQOSA-N -1 2 424.471 4.272 10 30 HIEELM CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[P@@](=O)([O-])O)NC(C)=O ZINC000056870937 519985240 /nfs/dbraw/zinc/98/52/40/519985240.db2.gz HWPZKJVGDYNEAW-QUDYQQOWSA-N -1 2 421.515 4.219 10 30 in-vitro HIEELM CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[P@](=O)([O-])O)NC(C)=O ZINC000056870937 519985245 /nfs/dbraw/zinc/98/52/45/519985245.db2.gz HWPZKJVGDYNEAW-QUDYQQOWSA-N -1 2 421.515 4.219 10 30 in-vitro HIEELM CCCCCCCCCCCCCCCC(=O)OC[C@H](O)CO[P@@](=O)([O-])O ZINC000008218993 557776443 /nfs/dbraw/zinc/77/64/43/557776443.db2.gz YNDYKPRNFWPPFU-SFHVURJKSA-N -1 2 410.488 4.481 10 30 in-vitro HIEELM CCCCCCCCCCCCCCCC(=O)OC[C@H](O)CO[P@](=O)([O-])O ZINC000008218993 557776446 /nfs/dbraw/zinc/77/64/46/557776446.db2.gz YNDYKPRNFWPPFU-SFHVURJKSA-N -1 2 410.488 4.481 10 30 in-vitro HIEELM CCCCCCCC(=O)OC[C@H](CO[P@@](=O)([O-])O)OC(=O)CCCCCCC ZINC000036179002 541108703 /nfs/dbraw/zinc/10/87/03/541108703.db2.gz XYSBQYUENLDGMI-QGZVFWFLSA-N -1 2 424.471 4.272 10 30 in-vitro HIEELM CCCCCCCC(=O)OC[C@H](CO[P@](=O)([O-])O)OC(=O)CCCCCCC ZINC000036179002 541108708 /nfs/dbraw/zinc/10/87/08/541108708.db2.gz XYSBQYUENLDGMI-QGZVFWFLSA-N -1 2 424.471 4.272 10 30 in-vitro HIEELM