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

Formula:C14H9NO4Cl Mutagenic:high Tumorigenic:none Reproductive Effective:none 4-chloro-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoate is a drug-like molecule.

MolName	4-chloro-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoate
MolecularFormula	C14H9NO4Cl
Smiles	[O-]C(c(ccc(Cl)c1)c1NC(/C=C/c1ccco1)=O)=O
InChI	InChI=1S/C14H10ClNO4/c15-9-3-5-11(14(18)19)12(8-9)16-13(17)6-4-10-2-1-7-20-10/h1-8H,(H,16,17)(H,18,19)/p-1
InChIK	NEJHSZBHFANDPO-UHFFFAOYSA-M
TotalMolweight	290.681
Molweight	290.681
MonoisotopicMass	290.022011
CLogP	0.3401
CLogS	-3.929
H Acceptors	5
H Donors	1
TotalSurfaceArea	219.12
Relative PSA	0.30089
PolarSurfaceArea	82.37
Druglikeness	0.039214
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
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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