COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL011018
Chemical Name: N-[(2S)-1-{[3-(dimethylamino)propyl]amino}-4-(methylsulfanyl)-1-oxobutan-2-yl]-5-ethyl-8-oxo-5,8-dihydro[1,3]dioxolo[4,5-g]quinoline-7-carboxamide
Smiles: CSCC[C@@H](C(=O)NCCCN(C)C)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1

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Molecular Weight: 476.6
Empirical Formula: C23H32N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.032
Rotatable bonds: 9
H-donors: 2
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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