COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL436303
Chemical Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(6-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)ethanone
Smiles: COc1ccc2c(c1)C(=CC(N2C(=O)CN1CCN(CC1)Cc1ccc2c(c1)OCO2)(C)C)C

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Saltdata: HCI
Molecular Weight: 463.58
Empirical Formula: C27H33N3O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.52
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 54
Number of rings: 5

     

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