smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features N[C@@H](CS(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)F)cc1)C(=O)O 169324955 USSRCIHEJYHDHI-QMMMGPOBSA-N 369.352 -1.679 70 1 FAIF