COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552764
Chemical Name: [(2R,2'R,5'R,6'S,8a'S)-6'-hydroxy-4,5'-bis(hydroxymethyl)-2',5',8a'-trimethyldecahydro-2'H,3H-spiro[furan-2,1'-naphthalen]-4-yl]acetate
Smiles: OCC1(CO[C@]2(C1)[C@H](C)CCC1[C@]2(C)CC[C@@H]([C@@]1(C)CO)O)CC(=O)[O-]

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Saltdata: Na+
Molecular Weight: 369.48
Empirical Formula: C20H33O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.95
Rotatable bonds: 4
H-donors: 3
H-acceptors: 6
PSA: 110
Number of rings: 3

     

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