[2-oxo-2-(4-sulfamoylanilino)ethyl] (4E)-4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Formula:C29H24N4O7S Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-oxo-2-(4-sulfamoylanilino)ethyl] (4E)-4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate is not a drug-like molecule.

MolName	[2-oxo-2-(4-sulfamoylanilino)ethyl] (4E)-4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate
MolecularFormula	C29H24N4O7S
Smiles	NS(c(cc1)ccc1NC(COC(c1c(CCC/C2=C\c(cc3)ccc3[N+]([O-])=O)c2nc2ccccc12)=O)=O)(=O)=O
InChI	InChI=1S/C29H24N4O7S/c30-41(38,39)22-14-10-20(11-15-22)31-26(34)17-40-29(35)27-23-5-1-2-7-25(23)32-28-19(4-3-6-24(27)28)16-18-8-12-21(13-9-18)33(36)37/h1-2,5,7-16H,3-4,6,17H2,(H,31,34)(H2,30,38,39)
InChIK	JQEYPKPGJNIZBE-UHFFFAOYSA-N
TotalMolweight	572.597
Molweight	572.597
MonoisotopicMass	572.136571
CLogP	3.231
CLogS	-6.574
H Acceptors	11
H Donors	2
TotalSurfaceArea	410.12
Relative PSA	0.32376
PolarSurfaceArea	182.65
Druglikeness	-7.5127
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.53659
Fragments	1
Non HAtoms	41
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	7
Symmetricatoms	5
Amides	2
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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