COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114800
Chemical Name: N-{[5-({2-[(2-bromo-4,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-4-chlorobenzamide
Smiles: O=C(Nc1cc(C)c(cc1Br)C)CSc1nnc(n1C)CNC(=O)c1ccc(cc1)Cl

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Molecular Weight: 522.85
Empirical Formula: C21H21BrClN5O2S

Physical State: Dry powder
Available Amount: 147 mg

Lipinsky:
logP: 4.4
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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