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

Formula:C19H11N4Cl2S Mutagenic:low Tumorigenic:none Reproductive Effective:none 3-(2,4-dichlorophenyl)-2-thiophen-2-yl-1H-imidazo[4,5-b]quinoxalin-3-ium is a drug-like molecule.

MolName	3-(2,4-dichlorophenyl)-2-thiophen-2-yl-1H-imidazo[4,5-b]quinoxalin-3-ium
MolecularFormula	C19H11N4Cl2S
Smiles	Clc(cc1)cc(Cl)c1-[n+]1c(-c2cccs2)[nH]c2nc3ccccc3nc12
InChI	InChI=1S/C19H10Cl2N4S/c20-11-7-8-15(12(21)10-11)25-18(16-6-3-9-26-16)24-17-19(25)23-14-5-2-1-4-13(14)22-17/h1-10H/p+1
InChIK	SCXZMLBPAFTJOP-UHFFFAOYSA-O
TotalMolweight	398.296
Molweight	398.296
MonoisotopicMass	397.008145
CLogP	4.8024
CLogS	-10.15
H Acceptors	4
H Donors	1
TotalSurfaceArea	273.15
Relative PSA	0.21618
PolarSurfaceArea	73.69
Druglikeness	1.9177
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	tert. immonium
Shape Index	0.46154
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	2
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	24
Aromatic Nitrogens	4
StereoCon

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