smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCC(=O)N[C@H](c1ccccc1)C1(OP(=O)([O-])[O-])CCC1 ZINC000043443100 205083938 /nfs/dbraw/zinc/08/39/38/205083938.db2.gz YRRPNJYJCVOPJG-GOSISDBHSA-N -2 0 383.425 4.236 1 30 GIEFRL CCCCCCCCCCCCCC(=O)OC[C@@H](COP(=O)([O-])[O-])OC ZINC000084596780 208093923 /nfs/dbraw/zinc/09/39/23/208093923.db2.gz IYLAGDPJYVISHL-KRWDZBQOSA-N -2 0 396.461 4.355 1 30 GIEFRL O=C([O-])CCCCC=C1C(=O)c2ccccc2C(=O)C1CCCCCC(=O)[O-] ZINC000013861901 207001930 /nfs/dbraw/zinc/00/19/30/207001930.db2.gz INOVTVXDRPCKHN-UHFFFAOYSA-N -2 0 386.444 4.432 1 30 GIEFRL CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC ZINC000084596781 211171201 /nfs/dbraw/zinc/17/12/01/211171201.db2.gz IYLAGDPJYVISHL-QGZVFWFLSA-N -2 0 396.461 4.355 1 30 GIEFRL