smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC[Si](Cl)(CC)C(C)(C)C 197270446 RWXVMOBDVOAUHW-UHFFFAOYSA-N 178.779 4.011 70 40 AIIB [B](C1CCCCC1)C1CCCCC1 195862856 LUHUASWMJCSDTG-UHFFFAOYSA-N 177.120 4.196 70 40 AIIB CCCC(C)(C)[Si](C)(C)Cl 196046690 KAADXUXXXANQKW-UHFFFAOYSA-N 178.779 4.011 70 40 AIIB CC(C)(C)[Si](C)(Cl)C(C)(C)C 195751427 YCIGMXVAUVFHGG-UHFFFAOYSA-N 192.806 4.401 70 40 AIIB