COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK994896
Chemical Name: (2E)-2-(3,4-dimethoxybenzylidene)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)hydrazinecarbothioamide
Smiles: COc1cc(/C=N/NC(=S)Nc2c(C)n(n(c2=O)c2ccccc2)C)ccc1OC

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Molecular Weight: 425.51
Empirical Formula: C21H23N5O3S

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 2.27
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 110
Number of rings: 3

     

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