COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK289100
Chemical Name: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccccc1c1nnc(n1CC)SCC(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 408.52
Empirical Formula: C22H24N4O2S

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 4.719
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 85
Number of rings: 4

     

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