COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL010606
Chemical Name: (3S,4S,9bR)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
Smiles: O[C@H]1CC(=C2C([C@@H]3C1[C@H](C)C(=O)O3)C(=CC2=O)C)C

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Saltdata: H2O
Molecular Weight: 262.31
Empirical Formula: C15H18O4

Physical State: Dry powder
Available Amount: 1128 mg

Lipinsky:
logP: 0.729
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 3

     

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