COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK450349
Chemical Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1OC)CCn1c(S)nnc1Cc1cccs1

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Molecular Weight: 361.49
Empirical Formula: C17H19N3O2S2

Physical State: Dry powder
Available Amount: 216 mg

Lipinsky:
logP: 3.936
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 3

     

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