COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL036654
Chemical Name: chloromethyl(8xi,9xi,11beta,14xi,17alpha)-17-[(ethoxycarbonyl)oxy]-11-hydroxy-3-oxoandrosta-1,4-diene-17-carboxylate
Smiles: ClCOC(=O)[C@]1(CCC2[C@]1(C)C[C@H](O)C1C2CCC2=CC(=O)C=C[C@]12C)OC(=O)OCC

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Molecular Weight: 466.96
Empirical Formula: C24H31ClO7

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 3.169
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 99
Number of rings: 4

     

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