COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079533
Chemical Name: 2-{[(4-methyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]sulfanyl}pyrimidine-4,6-diamine
Smiles: Nc1cc(N)nc(n1)SCc1nnc(n1C)SC/C=C/c1ccccc1

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Molecular Weight: 385.52
Empirical Formula: C17H19N7S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.195
Rotatable bonds: 5
H-donors: 4
H-acceptors: 0
PSA: 159
Number of rings: 3

     

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