COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK142031
Chemical Name: N-{1-[5-({2-[(4-bromo-3-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-2-methylpropyl}-3-methylbenzamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Br)CSc1nnc(n1C)C(C(C)C)NC(=O)c1cccc(c1)C

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Molecular Weight: 550.91
Empirical Formula: C23H25BrClN5O2S

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 5.991
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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