N-[(Z)-(1-prop-2-ynylindol-3-yl)methylideneamino]-2-quinolin-8-yloxyacetamide

Formula:C23H18N4O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(1-prop-2-ynylindol-3-yl)methylideneamino]-2-quinolin-8-yloxyacetamide is a drug-like molecule.

MolName	N-[(Z)-(1-prop-2-ynylindol-3-yl)methylideneamino]-2-quinolin-8-yloxyacetamide
MolecularFormula	C23H18N4O2
Smiles	C#CCn1c(cccc2)c2c(/C=N\NC(COc2cccc3cccnc23)=O)c1
InChI	InChI=1S/C23H18N4O2/c1-2-13-27-15-18(19-9-3-4-10-20(19)27)14-25-26-22(28)16-29-21-11-5-7-17-8-6-12-24-23(17)21/h1,3-12,14-15H,13,16H2,(H,26,28)
InChIK	LONDBUMELLWCNR-UHFFFAOYSA-N
TotalMolweight	382.422
Molweight	382.422
MonoisotopicMass	382.142976
CLogP	3.1416
CLogS	-4.724
H Acceptors	6
H Donors	1
TotalSurfaceArea	305.48
Relative PSA	0.20902
PolarSurfaceArea	68.51
Druglikeness	5.9484
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	19
Sp3Atoms	3
Aromatic Nitrogens	2
StereoCon

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