COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK891255
Chemical Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-4-(propan-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1cc(CCc2nnc(n2C(C)C)S)ccc1OC

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Molecular Weight: 307.42
Empirical Formula: C15H21N3O2S

Physical State: Dry powder
Available Amount: 444 mg

Lipinsky:
logP: 3.36
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 2

     

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