COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173345
Chemical Name: N-{(E)-[4-(difluoromethoxy)-3-methoxyphenyl]methylidene}-3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-amine
Smiles: CCSc1nnc(n1/N=C/c1ccc(c(c1)OC)OC(F)F)C

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Molecular Weight: 342.37
Empirical Formula: C14H16F2N4O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.594
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 2

     

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