COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172486
Chemical Name: 1-({4-[(4-chloro-2-nitrophenoxy)methyl]phenyl}carbonyl)octahydroquinolin-4(1H)-one
Smiles: O=C1CCN(C2C1CCCC2)C(=O)c1ccc(cc1)COc1ccc(cc1[N+](=O)[O-])Cl

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Molecular Weight: 442.9
Empirical Formula: C23H23ClN2O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.258
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 92
Number of rings: 4

     

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