COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114672
Chemical Name: 4-chloro-N-{[4-ethyl-5-({2-[(2-ethylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: CCn1c(CNC(=O)c2ccc(cc2)Cl)nnc1SCC(=O)Nc1ccccc1CC

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Molecular Weight: 457.98
Empirical Formula: C22H24ClN5O2S

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: 4.751
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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