COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL009049
Chemical Name: N-{6-[(2,3-dihydroxypropyl)amino]-6-oxohexyl}-5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: OCC(CNC(=O)CCCCCNC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)O

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Molecular Weight: 447.49
Empirical Formula: C22H29N3O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.8
Rotatable bonds: 13
H-donors: 4
H-acceptors: 7
PSA: 137
Number of rings: 3

     

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