COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401602
Chemical Name: (16E)-16-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylidene]-3-hydroxyandrostan-17-one
Smiles: CCn1nc(c(c1C)/C=C/1\CC2C(C1=O)(C)CCC1C2CCC2C1(C)CCC(C2)O)C

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Molecular Weight: 424.63
Empirical Formula: C27H40N2O2

Physical State: Dry powder
Available Amount: 42 mg

Lipinsky:
logP: 5.511
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 55
Number of rings: 5

     

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