smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+]1[Si](C)(C)[NH2+][SiH2]N[Si](C)(C)[N@@H+](C)[Si]1(C)C ZINC000169747583 567213741 /nfs/dbraw/zinc/21/37/41/567213741.db2.gz OVFDKWVWCVKIRM-UHFFFAOYSA-N 3 2 292.684 0.147 40 70 CCIBLP C[NH+]1[Si](C)(C)[NH2+][SiH2]N[Si](C)(C)[N@H+](C)[Si]1(C)C ZINC000169747583 567213748 /nfs/dbraw/zinc/21/37/48/567213748.db2.gz OVFDKWVWCVKIRM-UHFFFAOYSA-N 3 2 292.684 0.147 40 70 CCIBLP C[NH+]1[Si](C)(C)N[SiH2][NH2+][Si](C)(C)[N@H+](C)[Si]1(C)C ZINC000169747583 567213752 /nfs/dbraw/zinc/21/37/52/567213752.db2.gz OVFDKWVWCVKIRM-UHFFFAOYSA-N 3 2 292.684 0.147 40 70 CCIBLP C[NH+]1[Si](C)(C)N[SiH2][NH2+][Si](C)(C)[N@@H+](C)[Si]1(C)C ZINC000169747583 567213757 /nfs/dbraw/zinc/21/37/57/567213757.db2.gz OVFDKWVWCVKIRM-UHFFFAOYSA-N 3 2 292.684 0.147 40 70 CCIBLP