(11Z)-11-[(4-nitrophenyl)methylidene]indeno[1,2-b]quinoxaline

Formula:C22H13N3O2 Mutagenic:high Tumorigenic:none Reproductive Effective:high (11Z)-11-[(4-nitrophenyl)methylidene]indeno[1,2-b]quinoxaline is a drug-like molecule.

MolName	(11Z)-11-[(4-nitrophenyl)methylidene]indeno[1,2-b]quinoxaline
MolecularFormula	C22H13N3O2
Smiles	[O-][N+](c1ccc(/C=C2\c3nc4ccccc4nc3-c3c2cccc3)cc1)=O
InChI	InChI=1S/C22H13N3O2/c26-25(27)15-11-9-14(10-12-15)13-18-16-5-1-2-6-17(16)21-22(18)24-20-8-4-3-7-19(20)23-21/h1-13H
InChIK	XGZYKGWTODTUFL-UHFFFAOYSA-N
TotalMolweight	351.364
Molweight	351.364
MonoisotopicMass	351.100777
CLogP	3.9619
CLogS	-5.939
H Acceptors	5
TotalSurfaceArea	259.78
Relative PSA	0.20156
PolarSurfaceArea	71.6
Druglikeness	-5.8244
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.51852
Fragments	1
Non HAtoms	27
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	2
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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