COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL397572
Chemical Name: (16E)-16-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-3-hydroxyandrostan-17-one
Smiles: OC1CCC2(C(C1)CCC1C2CCC2(C1C/C(=C\c1cn(nc1C)C)/C2=O)C)C

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Molecular Weight: 396.57
Empirical Formula: C25H36N2O2

Physical State: Dry powder
Available Amount: 41 mg

Lipinsky:
logP: 4.52
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 55
Number of rings: 5

     

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