COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443040
Chemical Name: 5-[1-(3,5-dimethylphenoxy)ethyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Smiles: C=CCn1c(nnc1S)C(Oc1cc(C)cc(c1)C)C

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Molecular Weight: 289.4
Empirical Formula: C15H19N3OS

Physical State: Dry powder
Available Amount: 1829 mg

Lipinsky:
logP: 4.288
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 78
Number of rings: 2

     

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