COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK133264
Chemical Name: 3,4-dimethoxy-N-{[5-({2-oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: C=CCn1c(CNC(=O)c2ccc(c(c2)OC)OC)nnc1SCC(=O)Nc1c(Cl)cc(cc1Cl)Cl

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Molecular Weight: 570.88
Empirical Formula: C23H22Cl3N5O4S

Physical State: Dry powder
Available Amount: 222 mg

Lipinsky:
logP: 4.438
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 132
Number of rings: 3

     

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