COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL396384
Chemical Name: (16E)-16-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylidene]-3-methoxyestra-1,3,5(10)-trien-17-one
Smiles: COc1ccc2c(c1)CCC1C2CCC2(C1C/C(=C\c1cn(nc1C)CC)/C2=O)C

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Molecular Weight: 404.55
Empirical Formula: C26H32N2O2

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 5.624
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 44
Number of rings: 5

     

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