COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576396
Chemical Name: N-[5-(diethylsulfamoyl)-2-methylphenyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: CCN(S(=O)(=O)c1ccc(c(c1)NC(=S)N1CCc2c(C1)cc(c(c2)OC)OC)C)CC

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Molecular Weight: 477.65
Empirical Formula: C23H31N3O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.08
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 3

     

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