2-[(Z)-[1-[(2-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-4-nitrophenolate

Formula:C17H11N3O5F Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(Z)-[1-[(2-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-4-nitrophenolate is a drug-like molecule.

MolName	2-[(Z)-[1-[(2-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-4-nitrophenolate
MolecularFormula	C17H11N3O5F
Smiles	[O-]c(cc1)c(/C=C(/C(N2Cc(cccc3)c3F)=O)\NC2=O)cc1[N+]([O-])=O
InChI	InChI=1S/C17H12FN3O5/c18-13-4-2-1-3-10(13)9-20-16(23)14(19-17(20)24)8-11-7-12(21(25)26)5-6-15(11)22/h1-8,22H,9H2,(H,19,24)/p-1
InChIK	XLEBKQWWZYVUIE-UHFFFAOYSA-M
TotalMolweight	356.288
Molweight	356.288
MonoisotopicMass	356.068275
CLogP	-0.2052
CLogS	-4.175
H Acceptors	8
H Donors	1
TotalSurfaceArea	252.8
Relative PSA	0.33936
PolarSurfaceArea	118.29
Druglikeness	-1.5238
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; limit! 5-methylene-imidazolidine-2,4-dione
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Amides	2
AcidicOxygens	1
StereoCon

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1 - 2-[(Z)-[1-[(2-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-4-nitrophenolate | 2 - 2-[(Z)-[1-[(2-fluorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-4-nitrophenolate

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