COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK140124
Chemical Name: 4-bromo-N-{[5-({2-[(2-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-ethyl-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: CCn1c(CNC(=O)c2ccc(cc2)Br)nnc1SCC(=O)Nc1ccccc1Cl

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Molecular Weight: 508.83
Empirical Formula: C20H19BrClN5O2S

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 4.134
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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