smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C(=C1/CN2CCC1CC2)\c1ccccc1 28819336 166045139 /nfs/dbraw/zinc/04/51/39/166045139.db2.gz ULHUYFVJQMXTQV-UVTDQMKNSA-N 0 3 199.297 2.796 1 0 AFAFHN C(=C1\CN2CCC1CC2)\c1ccccc1 33840472 166045242 /nfs/dbraw/zinc/04/52/42/166045242.db2.gz ULHUYFVJQMXTQV-GXDHUFHOSA-N 0 3 199.297 2.796 1 0 AFAFHN C=C=C(Cc1ccccc1)CN(C)C 25991051 166150508 /nfs/dbraw/zinc/15/05/08/166150508.db2.gz DVOONHJHTQVWJG-UHFFFAOYSA-N 0 3 187.286 2.502 1 0 AFAFHN