[2-(carbamoylamino)-2-oxoethyl] (3Z)-3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate

Formula:C23H19N3O4 Mutagenic:low Tumorigenic:low Reproductive Effective:low [2-(carbamoylamino)-2-oxoethyl] (3Z)-3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate is a drug-like molecule.

MolName	[2-(carbamoylamino)-2-oxoethyl] (3Z)-3-benzylidene-1,2-dihydrocyclopenta[b]quinoline-9-carboxylate
MolecularFormula	C23H19N3O4
Smiles	NC(NC(COC(c1c(CC/C2=C/c3ccccc3)c2nc2ccccc12)=O)=O)=O
InChI	InChI=1S/C23H19N3O4/c24-23(29)26-19(27)13-30-22(28)20-16-8-4-5-9-18(16)25-21-15(10-11-17(20)21)12-14-6-2-1-3-7-14/h1-9,12H,10-11,13H2,(H3,24,26,27,29)
InChIK	KDCRTCUYDUBPAW-UHFFFAOYSA-N
TotalMolweight	401.421
Molweight	401.421
MonoisotopicMass	401.137557
CLogP	2.7721
CLogS	-4.983
H Acceptors	7
H Donors	2
TotalSurfaceArea	302.1
Relative PSA	0.28739
PolarSurfaceArea	111.38
Druglikeness	2.6857
Mutagenic	low
Tumorigenic	low
Reproductive Effective	low
Irritant	low
Nasty Functions
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	4
Symmetricatoms	2
Amides	2
Aromatic Nitrogens	1
StereoCon

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