COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118592
Chemical Name: N-{[5-({2-[(4-bromo-2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-4-chlorobenzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2C)C)Br)nnc1CNC(=O)c1ccc(cc1)Cl

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Molecular Weight: 536.88
Empirical Formula: C22H23BrClN5O2S

Physical State: Dry powder
Available Amount: 167 mg

Lipinsky:
logP: 5.887
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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