COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK657791
Chemical Name: 1-acetyl-N-[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]-1,2,3,4-tetrahydroquinoline-6-sulfonamide
Smiles: CN(C(c1ccc2c(c1)OCO2)CNS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)C)C

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Saltdata: HCl
Molecular Weight: 445.54
Empirical Formula: C22H27N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.045
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 4

     

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