COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK453964
Chemical Name: [2-(1,3-benzodioxol-5-yl)quinolin-4-yl]{4-[(4-chlorophenyl)sulfonyl]piperazin-1-yl}methanone
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2

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Molecular Weight: 536.01
Empirical Formula: C27H22ClN3O5S

Physical State: Dry powder
Available Amount: 1120 mg

Lipinsky:
logP: 4.245
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 97
Number of rings: 6

     

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