COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534407
Chemical Name: 5-ethyl-N-[(2S)-1-{[2-(4-hydroxyphenyl)ethyl]amino}-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CSCC[C@@H](C(=O)NCCc1ccc(cc1)O)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

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Molecular Weight: 511.6
Empirical Formula: C26H29N3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.098
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 142
Number of rings: 4

     

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