COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL266562
Chemical Name: N-(3-chloro-2-methylphenyl)-2-{[5-{[(3,4-dichlorophenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1CNc1ccc(c(c1)Cl)Cl

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Molecular Weight: 496.85
Empirical Formula: C21H20Cl3N5OS

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 6.579
Rotatable bonds: 7
H-donors: 2
H-acceptors: 1
PSA: 97
Number of rings: 3

     

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