smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cl[Si](Cl)(Cl)CCc1ccc(CC[Si](Cl)(Cl)Cl)cc1 196515817 DJKJUWNMLWCGMU-UHFFFAOYSA-N 401.096 6.082 70 30 HKIC CCCCCCCCCCCCCCCCCC[Si](Cl)(OCC)OCC 198629605 YEUMDCKZUIDORC-UHFFFAOYSA-N 407.155 8.499 70 30 HKIC Cl[Si](O[Si](Cl)(C1CCCC1)C1CCCC1)(C1CCCC1)C1CCCC1 196688201 CSXBFXZXTMXDJZ-UHFFFAOYSA-N 419.585 8.142 70 30 HKIC CC(C)c1c(OS(=O)(=O)C(F)(F)F)ccc2c1CC[C@H]1C(C)(C)CCC[C@]21C 100136217 RCHRXHBOXLBCOW-FXAWDEMLSA-N 418.521 6.069 70 30 HKIC C[Si](C)(Cl)CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C 204957005 LUGNIGZCYCQQJR-UHFFFAOYSA-N 417.319 5.924 70 30 HKIC O=S(=O)(Cl)c1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3)cs2)cc1 100004531 UGHITQRMICHJDI-UHFFFAOYSA-N 403.834 5.423 70 30 HKIC