COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL419461
Chemical Name: 3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-1-ethyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: CCc1nc(SCc2nc3c([nH]2)cccc3)c(c2c1CCCC2)C#N

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Molecular Weight: 348.47
Empirical Formula: C20H20N4S

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 5.354
Rotatable bonds: 3
H-donors: 1
H-acceptors: 0
PSA: 90
Number of rings: 4

     

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