COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK018391
Chemical Name: 2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-6-yl2-chloro-5-nitrobenzoate
Smiles: CC1CC(C)(C)Nc2c1cc(cc2)OC(=O)c1cc(ccc1Cl)[N+](=O)[O-]

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Molecular Weight: 374.82
Empirical Formula: C19H19ClN2O4

Physical State: Dry powder
Available Amount: 656 mg

Lipinsky:
logP: 5.361
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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