2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoate

Formula:C14H10NO4 Mutagenic:high Tumorigenic:none Reproductive Effective:none 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoate is a drug-like molecule.

MolName	2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoate
MolecularFormula	C14H10NO4
Smiles	[O-]C(c(cccc1)c1NC(/C=C/c1ccco1)=O)=O
InChI	InChI=1S/C14H11NO4/c16-13(8-7-10-4-3-9-19-10)15-12-6-2-1-5-11(12)14(17)18/h1-9H,(H,15,16)(H,17,18)/p-1
InChIK	ZQZWZICEYIOQMW-UHFFFAOYSA-M
TotalMolweight	256.236
Molweight	256.236
MonoisotopicMass	256.060984
CLogP	-0.2659
CLogS	-3.193
H Acceptors	5
H Donors	1
TotalSurfaceArea	203.7
Relative PSA	0.32366
PolarSurfaceArea	82.37
Druglikeness	-0.051794
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57895
Fragments	1
Non HAtoms	19
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Amides	1
AcidicOxygens	1
StereoCon

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1 - 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoate | 2 - 2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoate

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