[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

Formula:C14H11N2O4Cl Mutagenic:high Tumorigenic:none Reproductive Effective:none [2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-[(2-chloropyridin-3-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C14H11N2O4Cl
Smiles	O=C(COC(/C=C/c1ccco1)=O)Nc1cccnc1Cl
InChI	InChI=1S/C14H11ClN2O4/c15-14-11(4-1-7-16-14)17-12(18)9-21-13(19)6-5-10-3-2-8-20-10/h1-8H,9H2,(H,17,18)
InChIK	MIYZOWUVDDHOFW-UHFFFAOYSA-N
TotalMolweight	306.704
Molweight	306.704
MonoisotopicMass	306.040735
CLogP	1.5854
CLogS	-2.787
H Acceptors	6
H Donors	1
TotalSurfaceArea	234.11
Relative PSA	0.3102
PolarSurfaceArea	81.43
Druglikeness	0.25997
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	21
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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