COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK979804
Chemical Name: 1,5-dimethyl-4-[(E)-{[3-(methylsulfanyl)-5-phenyl-4H-1,2,4-triazol-4-yl]imino}methyl]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: CSc1nnc(n1/N=C/c1c(=O)n(n(c1C)C)c1ccccc1)c1ccccc1

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Molecular Weight: 404.5
Empirical Formula: C21H20N6OS

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 3.571
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 91
Number of rings: 4

     

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