[4-[(Z)-(2,5-dioxoimidazolidin-4-ylidene)methyl]phenyl] 3-chloro-4-fluorobenzoate

Formula:C17H10N2O4ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-(2,5-dioxoimidazolidin-4-ylidene)methyl]phenyl] 3-chloro-4-fluorobenzoate is a drug-like molecule.

MolName	[4-[(Z)-(2,5-dioxoimidazolidin-4-ylidene)methyl]phenyl] 3-chloro-4-fluorobenzoate
MolecularFormula	C17H10N2O4ClF
Smiles	O=C(c(cc1)cc(Cl)c1F)Oc1ccc(/C=C(/C(N2)=O)\NC2=O)cc1
InChI	InChI=1S/C17H10ClFN2O4/c18-12-8-10(3-6-13(12)19)16(23)25-11-4-1-9(2-5-11)7-14-15(22)21-17(24)20-14/h1-8H,(H2,20,21,22,24)
InChIK	BPPMTMUBKAXUFF-UHFFFAOYSA-N
TotalMolweight	360.727
Molweight	360.727
MonoisotopicMass	360.031313
CLogP	3.0056
CLogS	-5.256
H Acceptors	6
H Donors	2
TotalSurfaceArea	252.17
Relative PSA	0.28568
PolarSurfaceArea	84.5
Druglikeness	1.8103
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! 5-methylene-imidazolidine-2,4-dione
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
Amides	2
StereoCon

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