COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245515
Chemical Name: 2-bromo-N-{[4-ethyl-5-({2-[(4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C)nnc1CNC(=O)c1ccccc1Br

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Molecular Weight: 488.41
Empirical Formula: C21H22BrN5O2S

Physical State: Dry powder
Available Amount: 125 mg

Lipinsky:
logP: 3.805
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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