COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK594186
Chemical Name: 4-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-N,N-diethyl-3-nitrobenzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCc2c(C1)cc(c(c2)OC)OC)CC

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Molecular Weight: 449.53
Empirical Formula: C21H27N3O6S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 5.087
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 113
Number of rings: 3

     

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