COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576085
Chemical Name: (2Z)-N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)ethanethioamide
Smiles: CCN(S(=O)(=O)c1ccc(c(c1)NC(=S)/C=C/1\NCCc2c1cc(OC)c(c2)OC)C)CC

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Molecular Weight: 489.66
Empirical Formula: C24H31N3O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.134
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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