smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC(=[NH2+])NCCCCCCCCCCCCNC(=[NH2+])CC ZINC000064548660 184298979 /nfs/dbraw/zinc/29/89/79/184298979.db2.gz NBTYUYFZJPWCHX-UHFFFAOYSA-N 2 0 310.530 4.841 1 0 DJAFRP CCNC(=[NH2+])CCCCCCCCCCCCC(=[NH2+])NCC ZINC000045246018 183490326 /nfs/dbraw/zinc/49/03/26/183490326.db2.gz PUTCZONAUAKYKN-UHFFFAOYSA-N 2 0 310.530 4.841 1 0 DJAFRP