COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL358625
Chemical Name: (4Z)-2-(4-bromo-2-methylphenyl)-5-methyl-4-{[(5-methyl-2,1,3-benzothiadiazol-4-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1ccc(c(c1)C)N1N=C(/C(=C/Nc2c(C)ccc3c2nsn3)/C1=O)C

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Molecular Weight: 442.34
Empirical Formula: C19H16BrN5OS

Physical State: Dry powder
Available Amount: 438 mg

Lipinsky:
logP: 3.667
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 98
Number of rings: 4

     

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