smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C=CCCCC/C=C/CCCCCC 2386952 FAQAIHMZMAIJCR-BUHFOSPRSA-N 194.362 5.259 30 30 AKEC C=C(CC)CCCCCCCCCC 60107600 HJXYLVWUVYMJKO-UHFFFAOYSA-N 196.378 5.483 30 30 AKEC C=C/C=C/CCCCCCCCCC 80530567 LRIUTQPZISVIHK-FNORWQNLSA-N 194.362 5.259 30 30 AKEC CCCCCCCC/C=C(\C)C(C)C 78165870 VHLOJMKUCZZJEL-WYMLVPIESA-N 196.378 5.339 30 30 AKEC