COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK030722
Chemical Name: 3-(benzylsulfanyl)-N-[(E)-(4-bromophenyl)methylidene]-5-(pyridin-4-yl)-4H-1,2,4-triazol-4-amine
Smiles: Brc1ccc(cc1)/C=N/n1c(SCc2ccccc2)nnc1c1ccncc1

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Molecular Weight: 450.36
Empirical Formula: C21H16BrN5S

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 6.402
Rotatable bonds: 3
H-donors: 0
H-acceptors: 0
PSA: 81
Number of rings: 4

     

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