(E)-3-(6-phenoxypyridin-3-yl)prop-2-enoic acid

Formula:C14H11NO3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(6-phenoxypyridin-3-yl)prop-2-enoic acid is a drug-like molecule.

MolName	(E)-3-(6-phenoxypyridin-3-yl)prop-2-enoic acid
MolecularFormula	C14H11NO3
Smiles	OC(/C=C/c(cc1)cnc1Oc1ccccc1)=O
InChI	InChI=1S/C14H11NO3/c16-14(17)9-7-11-6-8-13(15-10-11)18-12-4-2-1-3-5-12/h1-10H,(H,16,17)
InChIK	TWPKEZACBDVQNY-UHFFFAOYSA-N
TotalMolweight	241.245
Molweight	241.245
MonoisotopicMass	241.073894
CLogP	2.22
CLogS	-4.026
H Acceptors	4
H Donors	1
TotalSurfaceArea	192.38
Relative PSA	0.24488
PolarSurfaceArea	59.42
Druglikeness	0.34618
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.72222
Fragments	1
Non HAtoms	18
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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