(E)-4-(naphthalen-1-ylamino)-4-oxobut-2-enoate

Formula:C14H10NO3 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-4-(naphthalen-1-ylamino)-4-oxobut-2-enoate is a drug-like molecule.

MolName	(E)-4-(naphthalen-1-ylamino)-4-oxobut-2-enoate
MolecularFormula	C14H10NO3
Smiles	[O-]C(/C=C/C(Nc1cccc2ccccc12)=O)=O
InChI	InChI=1S/C14H11NO3/c16-13(8-9-14(17)18)15-12-7-3-5-10-4-1-2-6-11(10)12/h1-9H,(H,15,16)(H,17,18)/p-1
InChIK	DNIIAZFRGKFYSJ-UHFFFAOYSA-M
TotalMolweight	240.237
Molweight	240.237
MonoisotopicMass	240.066069
CLogP	-0.138
CLogS	-3.351
H Acceptors	4
H Donors	1
TotalSurfaceArea	188.85
Relative PSA	0.2744
PolarSurfaceArea	69.23
Druglikeness	-0.13705
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61111
Fragments	1
Non HAtoms	18
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	10
Sp3Atoms	1
Amides	1
AcidicOxygens	1
StereoCon

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