COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL174369
Chemical Name: 2-amino-1-(4-chloro-3-nitrophenyl)-5-oxo-7-phenyl-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(c(c2)[N+](=O)[O-])Cl)C2=C(C1c1ccccc1C(F)(F)F)C(=O)CC(C2)c1ccccc1

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Molecular Weight: 564.95
Empirical Formula: C29H20ClF3N4O3

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 4.875
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 5

     

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