COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL390657
Chemical Name: N-[(E)-{3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Smiles: COc1ccc(cc1Cn1ncc(c1)Br)/C=N/n1c(SC)nnc1C(F)F

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Molecular Weight: 457.3
Empirical Formula: C16H15BrF2N6OS

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 4.079
Rotatable bonds: 7
H-donors: 0
H-acceptors: 1
PSA: 95
Number of rings: 3

     

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