COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL276683
Chemical Name: 3-[(3,4-dimethoxybenzyl)sulfanyl]-4-(prop-2-en-1-yl)-6-{[3-(trifluoromethyl)phenyl]amino}-1,2,4-triazin-5(4H)-one
Smiles: C=CCn1c(nnc(c1=O)Nc1cccc(c1)C(F)(F)F)SCc1ccc(c(c1)OC)OC

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Molecular Weight: 478.5
Empirical Formula: C22H21F3N4O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.138
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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