COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK581358
Chemical Name: (5E)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-2-sulfanyl-1-(3,4,5-trimethoxyphenyl)pyrimidine-4,6(1H,5H)-dione
Smiles: COc1c(OC)cc(cc1OC)N1C(=NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O)S

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Molecular Weight: 523.57
Empirical Formula: C25H25N5O6S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: -0.443
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 151
Number of rings: 4

     

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