smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCS[C@@H]1CCCc2ccccc21 ZINC000217778011 344406184 /nfs/dbraw/zinc/40/61/84/344406184.db2.gz YAWMHOWUGBHCSO-GFCCVEGCSA-N 0 0 192.327 3.817 20 70 AHIDRN CCS[C@H]1CCCc2ccccc21 ZINC000217778094 344406171 /nfs/dbraw/zinc/40/61/71/344406171.db2.gz YAWMHOWUGBHCSO-LBPRGKRZSA-N 0 0 192.327 3.817 20 70 AHIDRN CC(C)=CCOc1cccc(C)c1C ZINC000217835780 344406565 /nfs/dbraw/zinc/40/65/65/344406565.db2.gz CHUSWRKBDFFAQM-UHFFFAOYSA-N 0 0 190.286 3.648 20 70 AHIDRN CCNc1cccc(-c2ccccc2)c1 ZINC000218046359 487028964 /nfs/dbraw/zinc/02/89/64/487028964.db2.gz ZZCCJZXUOAKJMJ-UHFFFAOYSA-N 0 0 197.281 3.785 20 70 AHIDRN