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

Formula:C27H20N2O4F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-(2,4-difluoroanilino)-2-oxoethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate is a drug-like molecule.

MolName	[2-(2,4-difluoroanilino)-2-oxoethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate
MolecularFormula	C27H20N2O4F2
Smiles	O=C(COC(c1c(CCC/C2=C\c3ccco3)c2nc2ccccc12)=O)Nc(ccc(F)c1)c1F
InChI	InChI=1S/C27H20F2N2O4/c28-17-10-11-23(21(29)14-17)30-24(32)15-35-27(33)25-19-7-1-2-9-22(19)31-26-16(5-3-8-20(25)26)13-18-6-4-12-34-18/h1-2,4,6-7,9-14H,3,5,8,15H2,(H,30,32)
InChIK	QUMSRHIRNIVXMY-UHFFFAOYSA-N
TotalMolweight	474.462
Molweight	474.462
MonoisotopicMass	474.139114
CLogP	4.7789
CLogS	-6.525
H Acceptors	6
H Donors	1
TotalSurfaceArea	351.74
Relative PSA	0.20646
PolarSurfaceArea	81.43
Druglikeness	-1.6358
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51429
Fragments	1
Non HAtoms	35
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	5
Amides	1
Aromatic Nitrogens	1
StereoCon

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1 - [2-(2,4-difluoroanilino)-2-oxoethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate | 2 - [2-(2,4-difluoroanilino)-2-oxoethyl] (4E)-4-(furan-2-ylmethylidene)-2,3-dihydro-1H-acridine-9-carboxylate

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