COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK470065
Chemical Name: methyl2-[({[4-ethyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]thiophene-3-carboxylate
Smiles: CCn1c(SCC(=O)Nc2sccc2C(=O)OC)nnc1c1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 492.58
Empirical Formula: C21H24N4O6S2

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 5.142
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 167
Number of rings: 3

     

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