COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL007385
Chemical Name: N-(4-{[(9xi,11beta,14xi)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl]oxy}-4-oxobutanoyl)leucine
Smiles: CC(CC(C(=O)O)NC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)C[C@H](O)C1[C@H]2CCC2=CC(=O)C=C[C@]12C)C

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Molecular Weight: 573.68
Empirical Formula: C31H43NO9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.02
Rotatable bonds: 11
H-donors: 4
H-acceptors: 9
PSA: 167
Number of rings: 4

     

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