COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK137721
Chemical Name: 3-methyl-N-({5-[(2-oxo-2-{[3-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}methyl)benzamide
Smiles: C=CCn1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1CNC(=O)c1cccc(c1)C

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Molecular Weight: 489.52
Empirical Formula: C23H22F3N5O2S

Physical State: Dry powder
Available Amount: 205 mg

Lipinsky:
logP: 4.908
Rotatable bonds: 8
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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