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

Formula:C23H20N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-(cyclopropylamino)-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate is a drug-like molecule.

MolName	[2-(cyclopropylamino)-2-oxoethyl] (3E)-3-(furan-2-ylmethylidene)-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
MolecularFormula	C23H20N2O4
Smiles	O=C(COC(c1c(CC/C2=C\c3ccco3)c2nc2ccccc12)=O)NC1CC1
InChI	InChI=1S/C23H20N2O4/c26-20(24-15-8-9-15)13-29-23(27)21-17-5-1-2-6-19(17)25-22-14(7-10-18(21)22)12-16-4-3-11-28-16/h1-6,11-12,15H,7-10,13H2,(H,24,26)
InChIK	DTHQCHBNYLXONF-UHFFFAOYSA-N
TotalMolweight	388.422
Molweight	388.422
MonoisotopicMass	388.142308
CLogP	3.0563
CLogS	-4.884
H Acceptors	6
H Donors	1
TotalSurfaceArea	292.04
Relative PSA	0.24866
PolarSurfaceArea	81.43
Druglikeness	2.5928
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	3
Aromatic Atoms	15
Sp3Atoms	7
Symmetricatoms	1
Amides	1
Aromatic Nitrogens	1
StereoCon

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