2-chloro-4-[5-[(Z)-[1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid

Formula:C22H14N2O5ClF Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-chloro-4-[5-[(Z)-[1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid is a drug-like molecule.

MolName	2-chloro-4-[5-[(Z)-[1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid
MolecularFormula	C22H14N2O5ClF
Smiles	OC(c(ccc(-c1ccc(/C=C(/C(N2Cc(cc3)ccc3F)=O)\NC2=O)o1)c1)c1Cl)=O
InChI	InChI=1S/C22H14ClFN2O5/c23-17-9-13(3-7-16(17)21(28)29)19-8-6-15(31-19)10-18-20(27)26(22(30)25-18)11-12-1-4-14(24)5-2-12/h1-10H,11H2,(H,25,30)(H,28,29)
InChIK	AUEAQWAEBFGRIQ-UHFFFAOYSA-N
TotalMolweight	440.813
Molweight	440.813
MonoisotopicMass	440.057528
CLogP	3.6701
CLogS	-6.22
H Acceptors	7
H Donors	2
TotalSurfaceArea	310.57
Relative PSA	0.26191
PolarSurfaceArea	99.85
Druglikeness	4.3518
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! 5-methylene-imidazolidine-2,4-dione
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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1 - 2-chloro-4-[5-[(Z)-[1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid | 2 - 2-chloro-4-[5-[(Z)-[1-[(4-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid

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