COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK177204
Chemical Name: (2E)-2-[(17E)-16-(acetyloxy)-3,11-dihydroxy-4,8,10,14-tetramethylgonan-17-ylidene]-6-methylhept-5-enoicacid
Smiles: CC(=O)OC1CC2(C(/C/1=C(\C(=O)O)/CCC=C(C)C)CC(C1C2(C)CCC2C1(C)CCC(C2C)O)O)C

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Molecular Weight: 516.72
Empirical Formula: C31H48O6

Physical State: Dry powder
Available Amount: 5301 mg

Lipinsky:
logP: 6.415
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 104
Number of rings: 4

     

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