COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK450354
Chemical Name: 5-(5-chlorothiophen-2-yl)-4-[2-(3,4-dimethoxyphenyl)ethyl]-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1OC)CCn1c(S)nnc1c1ccc(s1)Cl

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Molecular Weight: 381.91
Empirical Formula: C16H16ClN3O2S2

Physical State: Dry powder
Available Amount: 236 mg

Lipinsky:
logP: 5.119
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 3

     

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