COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139603
Chemical Name: 2-[5-({2-[(4-bromo-2,3-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-N-(3-methoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2C)C)Br)nnc1CC(=O)Nc1cccc(c1)OC

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Molecular Weight: 544.47
Empirical Formula: C24H26BrN5O3S

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: 5.849
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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