COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL435351
Chemical Name: 5-{[(3-chlorophenyl)amino]methyl}-2-[3-(trifluoromethyl)benzyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Smiles: Clc1cccc(c1)NCc1nn(c(=O)[nH]1)Cc1cccc(c1)C(F)(F)F

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Molecular Weight: 382.77
Empirical Formula: C17H14ClF3N4O

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 2.775
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 56
Number of rings: 3

     

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