2,3-diphenyl-1H-imidazo[4,5-b]quinoxalin-3-ium

Formula:C21H15N4 Mutagenic:low Tumorigenic:none Reproductive Effective:none 2,3-diphenyl-1H-imidazo[4,5-b]quinoxalin-3-ium is a drug-like molecule.

MolName	2,3-diphenyl-1H-imidazo[4,5-b]quinoxalin-3-ium
MolecularFormula	C21H15N4
Smiles	c(cc1)ccc1-c([nH]c1nc2ccccc2nc11)[n+]1-c1ccccc1
InChI	InChI=1S/C21H14N4/c1-3-9-15(10-4-1)20-24-19-21(25(20)16-11-5-2-6-12-16)23-18-14-8-7-13-17(18)22-19/h1-14H/p+1
InChIK	JIIQDJATVCZWKB-UHFFFAOYSA-O
TotalMolweight	323.378
Molweight	323.378
MonoisotopicMass	323.129671
CLogP	3.5669
CLogS	-8.757
H Acceptors	4
H Donors	1
TotalSurfaceArea	246.37
Relative PSA	0.15704
PolarSurfaceArea	45.45
Druglikeness	-0.95348
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	tert. immonium
Shape Index	0.44
Fragments	1
Non HAtoms	25
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	2
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Symmetricatoms	4
Aromatic Nitrogens	4
StereoCon

Click to Load Molecule: