COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK197790
Chemical Name: 2-[5-({2-[(4-bromo-3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-N-(2-ethylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)Br)nnc1CC(=O)Nc1ccccc1CC

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Molecular Weight: 548.89
Empirical Formula: C23H23BrClN5O2S

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 6.385
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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