[(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] morpholine-4-carboxylate

Formula:C17H19N3O3 Mutagenic:none Tumorigenic:high Reproductive Effective:none [(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] morpholine-4-carboxylate is a drug-like molecule.

MolName	[(E)-(1-amino-2-naphthalen-1-ylethylidene)amino] morpholine-4-carboxylate
MolecularFormula	C17H19N3O3
Smiles	N/C(/Cc1cccc2ccccc12)=N/OC(N1CCOCC1)=O
InChI	InChI=1S/C17H19N3O3/c18-16(19-23-17(21)20-8-10-22-11-9-20)12-14-6-3-5-13-4-1-2-7-15(13)14/h1-7H,8-12H2,(H2,18,19)
InChIK	ONVRFFJRASWLTG-UHFFFAOYSA-N
TotalMolweight	313.356
Molweight	313.356
MonoisotopicMass	313.142642
CLogP	2.7853
CLogS	-3.821
H Acceptors	6
H Donors	1
TotalSurfaceArea	242.7
Relative PSA	0.2611
PolarSurfaceArea	77.15
Druglikeness	-3.0953
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	7
Symmetricatoms	2
Amides	1
StereoCon

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