COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553532
Chemical Name: 4-({2-[(3-carboxypropanoyl)oxy]-1,4a-dimethyl-6-methylidene-5-[(E)-2-(2-oxo-2,5-dihydrofuran-3-yl)ethenyl]decahydronaphthalen-1-yl}methoxy)-4-oxobutanoate
Smiles: [O-]C(=O)CCC(=O)OCC1(C)C(CCC2(C1CCC(=C)C2/C=C/C1=CCOC1=O)C)OC(=O)CCC(=O)O

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Saltdata: K+
Molecular Weight: 531.58
Empirical Formula: C28H35O10

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.85
Rotatable bonds: 13
H-donors: 1
H-acceptors: 10
PSA: 156
Number of rings: 3

     

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