COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK136576
Chemical Name: 2-bromo-N-(1-{5-[(2-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}ethyl)benzamide
Smiles: CCn1c(SCC(=O)Nc2cc(ccc2Cl)C(F)(F)F)nnc1C(NC(=O)c1ccccc1Br)C

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Molecular Weight: 590.85
Empirical Formula: C22H20BrClF3N5O2S

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 5.08
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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