COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527180
Chemical Name: (8xi,9xi,14xi)-17-(acetyloxy)-3,20-dioxopregn-4-en-21-yl4-[(2-methoxy-2-oxo-1-phenylethyl)amino]-4-oxobutanoate
Smiles: COC(=O)C(c1ccccc1)NC(=O)CCC(=O)OCC(=O)[C@]1(CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)OC(=O)C

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Molecular Weight: 635.75
Empirical Formula: C36H45NO9

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.429
Rotatable bonds: 11
H-donors: 1
H-acceptors: 9
PSA: 142
Number of rings: 5

     

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