COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528276
Chemical Name: 4-{[N-(4-{[(8xi,9xi,10xi,13xi,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl]oxy}-4-oxobutanoyl)valyl]amino}-3-phenylbutanoicacid
Smiles: O=C(OCC(=O)[C@@]1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)CCC12C)CCC(=O)NC(C(=O)NCC(c1ccccc1)CC(=O)O)C(C)C

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Molecular Weight: 722.88
Empirical Formula: C40H54N2O10

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.553
Rotatable bonds: 16
H-donors: 5
H-acceptors: 10
PSA: 196
Number of rings: 5

     

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