smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CC(=O)OC[C@H]1O[C@H](O[C@H]2[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](O)O[C@@H]2COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1O 217366834 LILBYIPNRVSZHK-VMPTWCPTSA-N 594.519 -1.972 70 10 KAIE O=C(CBr)CO[P@](=O)(O)O[P@](=O)(O)O[C@@H]1[C@@H](CO)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@H]1O 135833634 RISBOGPWYUPYJG-QCNRFFRDSA-N 539.121 -1.630 70 10 KAIE COc1cc2oc(-c3ccc(O)cc3)cc(=O)c2c(O)c1[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O 160585817 LTSHFAAMUZRJGB-OOAZWYKYSA-N 608.549 -1.781 70 10 KAIE