[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

Formula:C25H22N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate is a drug-like molecule.

MolName	[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
MolecularFormula	C25H22N2O5
Smiles	O=C(COC(c1c(CCC/C2=C\c3ccco3)c2nc2ccccc12)=O)N(CCC1)C1=O
InChI	InChI=1S/C25H22N2O5/c28-21-11-4-12-27(21)22(29)15-32-25(30)23-18-8-1-2-10-20(18)26-24-16(6-3-9-19(23)24)14-17-7-5-13-31-17/h1-2,5,7-8,10,13-14H,3-4,6,9,11-12,15H2
InChIK	ULFHWHPZMUNMAA-UHFFFAOYSA-N
TotalMolweight	430.459
Molweight	430.459
MonoisotopicMass	430.152873
CLogP	3.3599
CLogS	-4.696
H Acceptors	7
TotalSurfaceArea	323.65
Relative PSA	0.24023
PolarSurfaceArea	89.71
Druglikeness	2.4841
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46875
Fragments	1
Non HAtoms	32
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	8
Amides	1
Aromatic Nitrogens	1
StereoCon

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1 - [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate | 2 - [2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

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