smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1cc(C)cc(/N=N/c2cc(C)cc(C)c2)c1 32131968 KQJYKIFOKLVEKF-ISLYRVAYSA-N 238.334 5.336 10 30 BKCC Cc1cccc(C)c1/N=N/c1c(C)cccc1C 5782370 XBEAJNFYXLTYFG-ISLYRVAYSA-N 238.334 5.336 10 30 BKCC