smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(/N=C/C=N/N(C)C1=NCCCN1)C1=NCCCN1 ZINC000001643170 351305157 /nfs/dbraw/zinc/30/51/57/351305157.db2.gz VJENDAJDWPDEKL-BEQMOXJMSA-N 1 3 278.364 -0.480 40 30 CBEBHO CN(/N=C/C=N/N(C)C1=[NH+]CCCN1)C1=NCCCN1 ZINC000001643170 351305159 /nfs/dbraw/zinc/30/51/59/351305159.db2.gz VJENDAJDWPDEKL-BEQMOXJMSA-N 1 3 278.364 -0.480 40 30 CBEBHO CN(/N=C\C=N/N(C)C1=[NH+]CCCN1)C1=NCCCN1 ZINC000008665447 230370568 /nfs/dbraw/zinc/37/05/68/230370568.db2.gz VJENDAJDWPDEKL-XFQWXJFMSA-N 1 3 278.364 -0.480 40 30 CBEBHO