COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK061020
Chemical Name: (2E)-N-[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)carbamothioyl]-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Smiles: O=C(NC(=S)Nc1c(C)nn(c1C)c1ccccc1)/C=C/c1ccc(cc1)C(C)C

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Molecular Weight: 418.56
Empirical Formula: C24H26N4OS

Physical State: Dry powder
Available Amount: 299 mg

Lipinsky:
logP: 6.39
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 91
Number of rings: 3

     

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