COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525813
Chemical Name: (4aR,6aS,6bS,9aR)-5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,4a,4b,5,6,6a,9a,10,10a,10b,11,12-dodecahydro-6bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxole-6b-carboxylicacid
Smiles: O=C1C=C[C@]2(C(=C1)CCC1C2C(O)C[C@]2(C1C[C@@H]1[C@]2(OC(O1)(C)C)C(=O)O)C)C

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Molecular Weight: 402.49
Empirical Formula: C23H30O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.224
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 93
Number of rings: 5

     

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