3-(2-chlorophenyl)-2-(4-chlorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium

Formula:C21H13N4Cl2 Mutagenic:low Tumorigenic:none Reproductive Effective:none 3-(2-chlorophenyl)-2-(4-chlorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium is a drug-like molecule.

MolName	3-(2-chlorophenyl)-2-(4-chlorophenyl)-1H-imidazo[4,5-b]quinoxalin-3-ium
MolecularFormula	C21H13N4Cl2
Smiles	Clc(cc1)ccc1-c([nH]c1nc2ccccc2nc11)[n+]1-c(cccc1)c1Cl
InChI	InChI=1S/C21H12Cl2N4/c22-14-11-9-13(10-12-14)20-26-19-21(25-17-7-3-2-6-16(17)24-19)27(20)18-8-4-1-5-15(18)23/h1-12H/p+1
InChIK	KJDHYQGHOSLWDS-UHFFFAOYSA-O
TotalMolweight	392.268
Molweight	392.268
MonoisotopicMass	391.051725
CLogP	4.7789
CLogS	-10.229
H Acceptors	4
H Donors	1
TotalSurfaceArea	277.21
Relative PSA	0.13957
PolarSurfaceArea	45.45
Druglikeness	-0.84083
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	tert. immonium
Shape Index	0.44444
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Symmetricatoms	2
Aromatic Nitrogens	4
StereoCon

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