COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL537834
Chemical Name: 17-hydroxy-3,20-dioxopregn-4-en-21-yl4-oxo-4-[(2-phenylethyl)amino]butanoate
Smiles: O=C(OCC(=O)[C@@]1(O)CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CCC2=CC(=O)CC[C@]12C)CCC(=O)NCCc1ccccc1

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Molecular Weight: 549.71
Empirical Formula: C33H43NO6

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 5.042
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 109
Number of rings: 5

     

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