COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114463
Chemical Name: N-{[5-({2-[(2-bromo-4,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethoxybenzamide
Smiles: CCn1c(CNC(=O)c2ccc(c(c2)OC)OC)nnc1SCC(=O)Nc1cc(C)c(cc1Br)C

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Molecular Weight: 562.49
Empirical Formula: C24H28BrN5O4S

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 3.876
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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