(Z)-3-(furan-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoic acid

Formula:C16H13NO4 Mutagenic:high Tumorigenic:none Reproductive Effective:none (Z)-3-(furan-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoic acid is a drug-like molecule.

MolName	(Z)-3-(furan-2-yl)-2-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoic acid
MolecularFormula	C16H13NO4
Smiles	OC(/C(/NC(/C=C/c1ccccc1)=O)=C/c1ccco1)=O
InChI	InChI=1S/C16H13NO4/c18-15(9-8-12-5-2-1-3-6-12)17-14(16(19)20)11-13-7-4-10-21-13/h1-11H,(H,17,18)(H,19,20)
InChIK	YHZJRKXWFYFSAB-UHFFFAOYSA-N
TotalMolweight	283.282
Molweight	283.282
MonoisotopicMass	283.084459
CLogP	2.2793
CLogS	-3.426
H Acceptors	5
H Donors	2
TotalSurfaceArea	227.23
Relative PSA	0.28495
PolarSurfaceArea	79.54
Druglikeness	-1.7743
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.61905
Fragments	1
Non HAtoms	21
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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