(2-anilino-2-oxoethyl) (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Formula:C27H22N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (2-anilino-2-oxoethyl) (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate is a drug-like molecule.

MolName	(2-anilino-2-oxoethyl) (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
MolecularFormula	C27H22N2O4
Smiles	O=C(COC(c1c(CCC/C2=C\c3ccco3)c2nc2ccccc12)=O)Nc1ccccc1
InChI	InChI=1S/C27H22N2O4/c30-24(28-19-9-2-1-3-10-19)17-33-27(31)25-21-12-4-5-14-23(21)29-26-18(8-6-13-22(25)26)16-20-11-7-15-32-20/h1-5,7,9-12,14-16H,6,8,13,17H2,(H,28,30)
InChIK	AJLHQTMFTVNDAX-UHFFFAOYSA-N
TotalMolweight	438.482
Molweight	438.482
MonoisotopicMass	438.157958
CLogP	4.5773
CLogS	-5.897
H Acceptors	6
H Donors	1
TotalSurfaceArea	339.04
Relative PSA	0.21419
PolarSurfaceArea	81.43
Druglikeness	-0.29582
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	5
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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