COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042153
Chemical Name: N,N-diethyl-4-[3-(5-phenyl-1H-pyrazol-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]aniline
Smiles: CCN(c1ccc(cc1)c1nn2c(s1)nnc2c1n[nH]c(c1)c1ccccc1)CC

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Molecular Weight: 415.52
Empirical Formula: C22H21N7S

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 6.188
Rotatable bonds: 3
H-donors: 1
H-acceptors: 0
PSA: 103
Number of rings: 5

     

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