COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL257061
Chemical Name: 11-[4-(dimethylamino)phenyl]-17-hydroxy-17-(prop-1-yn-1-yl)estra-4,9-dien-3-one
Smiles: CC#CC1(O)CCC2C1(C)CC(c1ccc(cc1)N(C)C)C1=C3CCC(=O)C=C3CCC21

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Molecular Weight: 429.6
Empirical Formula: C29H35NO2

Physical State: Dry powder
Available Amount: 1657 mg

Lipinsky:
logP: 4.945
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 40
Number of rings: 5

     

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