smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [SiH3]N([SiH2][N@@H+]([SiH3])C1CCC1)C1CCC1 ZINC000584644683 358329723 /nfs/dbraw/zinc/32/97/23/358329723.db2.gz SIYPJIQQJLUTKM-UHFFFAOYSA-N 1 1 230.536 -1.745 10 70 BAIEMO [SiH3]N([SiH2][N@H+]([SiH3])C1CCC1)C1CCC1 ZINC000584644683 358329721 /nfs/dbraw/zinc/32/97/21/358329721.db2.gz SIYPJIQQJLUTKM-UHFFFAOYSA-N 1 1 230.536 -1.745 10 70 BAIEMO CC(C)N([SiH3])[SiH2][N@@H+]([SiH3])C(C)C ZINC000584651786 358307009 /nfs/dbraw/zinc/30/70/09/358307009.db2.gz IQRMXLPPTAFXAU-UHFFFAOYSA-N 1 1 206.514 -2.033 10 70 BAIEMO CC(C)N([SiH3])[SiH2][N@H+]([SiH3])C(C)C ZINC000584651786 358307007 /nfs/dbraw/zinc/30/70/07/358307007.db2.gz IQRMXLPPTAFXAU-UHFFFAOYSA-N 1 1 206.514 -2.033 10 70 BAIEMO