4-[[2-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoic acid

Formula:C18H14N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[[2-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoic acid is a drug-like molecule.

MolName	4-[[2-[(E)-(2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy]methyl]benzoic acid
MolecularFormula	C18H14N2O5
Smiles	OC(c1ccc(COc2c(/C=C(\C(N3)=O)/NC3=O)cccc2)cc1)=O
InChI	InChI=1S/C18H14N2O5/c21-16-14(19-18(24)20-16)9-13-3-1-2-4-15(13)25-10-11-5-7-12(8-6-11)17(22)23/h1-9H,10H2,(H,22,23)(H2,19,20,21,24)
InChIK	FCZJIYUPTZZBCI-UHFFFAOYSA-N
TotalMolweight	338.318
Molweight	338.318
MonoisotopicMass	338.090273
CLogP	1.7015
CLogS	-4.09
H Acceptors	7
H Donors	3
TotalSurfaceArea	250.51
Relative PSA	0.33987
PolarSurfaceArea	104.73
Druglikeness	2.9361
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! 5-methylene-imidazolidine-2,4-dione
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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