smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC(C)(C)[Si](OCCOS(=O)(=O)C(F)(F)F)(c1ccccc1)c1ccccc1 213228288 VOKRBQUJSVSLSQ-UHFFFAOYSA-N 432.536 3.429 70 30 IGIC O=C(Cl)c1ccc2c(NS(=O)(=O)c3cccc(S(=O)(=O)F)c3)cccc2c1O 111421441 CMXGBVKIUVFXRA-UHFFFAOYSA-N 443.861 3.383 70 30 IGIC