COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245642
Chemical Name: 2-{[5-(5-chloro-1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Smiles: Clc1ccc2c(c1)cc(o2)c1nnc(n1C)SCC(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 438.94
Empirical Formula: C22H19ClN4O2S

Physical State: Dry powder
Available Amount: 131 mg

Lipinsky:
logP: 5.135
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 89
Number of rings: 5

     

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