COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK604166
Chemical Name: methyl5-({[4-cyano-1-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}methyl)furan-2-carboxylate
Smiles: COC(=O)c1ccc(o1)CSc1nc(N2CCOCC2)c2c(c1C#N)CCCC2

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Molecular Weight: 413.5
Empirical Formula: C21H23N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.393
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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