COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL000507
Chemical Name: (2E)-2-(4-bromobenzylidene)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)hydrazinecarbothioamide
Smiles: S=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)N/N=C/c1ccc(cc1)Br

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Molecular Weight: 444.36
Empirical Formula: C19H18BrN5OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.085
Rotatable bonds: 1
H-donors: 2
H-acceptors: 1
PSA: 92
Number of rings: 3

     

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