COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK074287
Chemical Name: 3-(benzylsulfanyl)-N-[(E)-(2,4-dichlorophenyl)methylidene]-5-(pyridin-4-yl)-4H-1,2,4-triazol-4-amine
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1c(SCc2ccccc2)nnc1c1ccncc1

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Molecular Weight: 440.36
Empirical Formula: C21H15Cl2N5S

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 6.928
Rotatable bonds: 4
H-donors: 0
H-acceptors: 0
PSA: 81
Number of rings: 4

     

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