smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+]1(C)CC(Br)=C(Br)[C@H](Br)C1 ZINC000001752759 717089804 /nfs/dbraw/zinc/08/98/04/717089804.db2.gz GKODXLSIKDJYHT-RXMQYKEDSA-N 1 0 348.884 2.841 50 50 EFGARO C[N+](C)(C)CCOCCP(=O)(c1ccccc1)c1ccccc1 ZINC000001866818 717091040 /nfs/dbraw/zinc/09/10/40/717091040.db2.gz CEPXJLVLNYCLKB-UHFFFAOYSA-N 1 0 332.404 2.723 50 50 EFGARO C[N+]1(C)CC(Br)=C(Br)[C@@H](Br)C1 ZINC000000494980 717087357 /nfs/dbraw/zinc/08/73/57/717087357.db2.gz GKODXLSIKDJYHT-YFKPBYRVSA-N 1 0 348.884 2.841 50 50 EFGARO