smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(OCc1ccccc1)N1CC[C@@]2(CS(=O)(=O)Cl)CCCC[C@H]12 685945707 QVHJFANBJXVBFQ-DOTOQJQBSA-N 371.886 3.527 70 30 FHIC O=C(NCCOCCOCCCCCCCl)OCc1ccccc1 149294634 SIEXBOGDNOFGSE-UHFFFAOYSA-N 357.878 3.745 70 30 FHIC O=C(OCc1ccccc1)N1CC[C@@]2(CS(=O)(=O)Cl)CCCC[C@@H]12 685945708 QVHJFANBJXVBFQ-NVXWUHKLSA-N 371.886 3.527 70 30 FHIC COC(=O)C(Cl)=P(c1ccccc1)(c1ccccc1)c1ccccc1 138172699 CTRCNDHBLJGUIP-UHFFFAOYSA-N 368.800 3.522 70 30 FHIC O=C(OCc1ccccc1)N1CC[C@]2(CS(=O)(=O)Cl)CCCC[C@@H]12 685945710 QVHJFANBJXVBFQ-WBVHZDCISA-N 371.886 3.527 70 30 FHIC O=C(OCc1ccccc1)N1CC[C@]2(CS(=O)(=O)Cl)CCCC[C@H]12 685945709 QVHJFANBJXVBFQ-RDJZCZTQSA-N 371.886 3.527 70 30 FHIC