1-(2,3-dihydroindol-1-yl)-2-[(Z)-(3-nitrophenyl)methylideneamino]oxyethanone

Formula:C17H15N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-(2,3-dihydroindol-1-yl)-2-[(Z)-(3-nitrophenyl)methylideneamino]oxyethanone is a drug-like molecule.

MolName	1-(2,3-dihydroindol-1-yl)-2-[(Z)-(3-nitrophenyl)methylideneamino]oxyethanone
MolecularFormula	C17H15N3O4
Smiles	[O-][N+](c1cc(/C=N\OCC(N(CC2)c3c2cccc3)=O)ccc1)=O
InChI	InChI=1S/C17H15N3O4/c21-17(19-9-8-14-5-1-2-7-16(14)19)12-24-18-11-13-4-3-6-15(10-13)20(22)23/h1-7,10-11H,8-9,12H2
InChIK	DXTSTEXPTYBFGR-UHFFFAOYSA-N
TotalMolweight	325.323
Molweight	325.323
MonoisotopicMass	325.106257
CLogP	2.6752
CLogS	-4.378
H Acceptors	7
TotalSurfaceArea	247.28
Relative PSA	0.27709
PolarSurfaceArea	87.72
Druglikeness	-1.0073
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Amides	1
AcidicOxygens	1
StereoCon

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