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+](C)(C)Cc1cc(-c2ccc(O)c(C[N+](C)(C)C)c2)ccc1[O-] ZINC000036466000 213099057 /nfs/dbraw/zinc/09/90/57/213099057.db2.gz JAXDNNWODZEONP-UHFFFAOYSA-P 1 3 330.472 3.177 1 10 EGCFHO CCC1C(=O)[n+]2c(-c3ccccc3)csc2N(CC2CC2)C1=O ZINC000101330679 219122313 /nfs/dbraw/zinc/12/23/13/219122313.db2.gz RZLNMBMFWWRXGJ-AWEZNQCLSA-N 1 3 327.429 3.126 1 10 EGCFHO CCC1C(=O)[n+]2c(-c3ccccc3)csc2N(CC2CC2)C1=O ZINC000101330682 219122321 /nfs/dbraw/zinc/12/23/21/219122321.db2.gz RZLNMBMFWWRXGJ-CQSZACIVSA-N 1 3 327.429 3.126 1 10 EGCFHO