(E)-4-[benzyl(furan-2-ylmethyl)amino]-4-oxobut-2-enoate

Formula:C16H14NO4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-4-[benzyl(furan-2-ylmethyl)amino]-4-oxobut-2-enoate is a drug-like molecule.

MolName	(E)-4-[benzyl(furan-2-ylmethyl)amino]-4-oxobut-2-enoate
MolecularFormula	C16H14NO4
Smiles	[O-]C(/C=C/C(N(Cc1ccco1)Cc1ccccc1)=O)=O
InChI	InChI=1S/C16H15NO4/c18-15(8-9-16(19)20)17(12-14-7-4-10-21-14)11-13-5-2-1-3-6-13/h1-10H,11-12H2,(H,19,20)/p-1
InChIK	BNQXPASBLAJLKD-UHFFFAOYSA-M
TotalMolweight	284.29
Molweight	284.29
MonoisotopicMass	284.092284
CLogP	-0.7497
CLogS	-2.204
H Acceptors	5
TotalSurfaceArea	230.06
Relative PSA	0.2522
PolarSurfaceArea	73.58
Druglikeness	2.1537
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52381
Fragments	1
Non HAtoms	21
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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