COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL010091
Chemical Name: 5-ethyl-N-[(2S)-1-(4-methylpiperazin-1-yl)-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)N1CCN(CC1)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

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Molecular Weight: 474.58
Empirical Formula: C23H30N4O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.574
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 116
Number of rings: 4

     

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