smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC(C)(C)OC(=O)N1CCc2cc(OS(=O)(=O)C(F)(F)F)ccc2C1 100471583 LHJUKWVEYQBUID-UHFFFAOYSA-N 381.372 3.208 70 30 GGIC O=S(=O)(Oc1cc(-c2ccccn2)nc(-c2ccccn2)c1)C(F)(F)F 100099632 OZRRTTUJPHVVRM-UHFFFAOYSA-N 381.335 3.434 70 30 GGIC CCCOc1cc(N2C(=O)c3ccccc3C2=O)ccc1S(=O)(=O)Cl 100035961 BFMSRWCVFIWETF-UHFFFAOYSA-N 379.821 3.204 70 30 GGIC CCOC(=O)c1cccc2nc(-c3ccc(S(=O)(=O)F)cc3)cc(O)c12 103833184 KRLWRCQREPLMRM-UHFFFAOYSA-N 375.377 3.442 70 30 GGIC CC(C)(C)OC(=O)N1CCc2cc(OS(=O)(=O)C(F)(F)F)cc(F)c2C1 1536221860 MOOHGLGAKCDROI-UHFFFAOYSA-N 399.362 3.347 70 30 GGIC