[2-(2-fluoroanilino)-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Formula:C26H19N2O4F Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-(2-fluoroanilino)-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate is a drug-like molecule.

MolName	[2-(2-fluoroanilino)-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
MolecularFormula	C26H19N2O4F
Smiles	O=C(COC(c1c(CC/C2=C\c3ccco3)c2nc2ccccc12)=O)Nc(cccc1)c1F
InChI	InChI=1S/C26H19FN2O4/c27-20-8-2-4-10-22(20)28-23(30)15-33-26(31)24-18-7-1-3-9-21(18)29-25-16(11-12-19(24)25)14-17-6-5-13-32-17/h1-10,13-14H,11-12,15H2,(H,28,30)
InChIK	KGHTXXUAWFSPKB-UHFFFAOYSA-N
TotalMolweight	442.445
Molweight	442.445
MonoisotopicMass	442.132886
CLogP	4.3361
CLogS	-5.941
H Acceptors	6
H Donors	1
TotalSurfaceArea	331.63
Relative PSA	0.21898
PolarSurfaceArea	81.43
Druglikeness	0.24418
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	4
Amides	1
Aromatic Nitrogens	1
StereoCon

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1 - [2-(2-fluoroanilino)-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate | 2 - [2-(2-fluoroanilino)-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

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