COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL017782
Chemical Name: 5-[1-(ethylsulfonyl)piperidin-3-yl]-4-[2-(4-methoxyphenyl)ethyl]-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1)CCn1c(S)nnc1C1CCCN(C1)S(=O)(=O)CC

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Molecular Weight: 410.56
Empirical Formula: C18H26N4O3S2

Physical State: Dry powder
Available Amount: 463 mg

Lipinsky:
logP: 3.339
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 3

     

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