2-chloro-5-[5-[(Z)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoate

Formula:C21H11N2O5Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 2-chloro-5-[5-[(Z)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoate is a drug-like molecule.

MolName	2-chloro-5-[5-[(Z)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl]furan-2-yl]benzoate
MolecularFormula	C21H11N2O5Cl2
Smiles	[O-]C(c(cc(cc1)-c2ccc(/C=C(/C(N3c4cc(Cl)ccc4)=O)\NC3=O)o2)c1Cl)=O
InChI	InChI=1S/C21H12Cl2N2O5/c22-12-2-1-3-13(9-12)25-19(26)17(24-21(25)29)10-14-5-7-18(30-14)11-4-6-16(23)15(8-11)20(27)28/h1-10H,(H,24,29)(H,27,28)/p-1
InChIK	BNTARNHDZXEHHY-UHFFFAOYSA-M
TotalMolweight	442.233
Molweight	442.233
MonoisotopicMass	441.004502
CLogP	2.1764
CLogS	-7.164
H Acceptors	7
H Donors	1
TotalSurfaceArea	307.06
Relative PSA	0.26874
PolarSurfaceArea	102.68
Druglikeness	4.8418
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! 5-methylene-imidazolidine-2,4-dione
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Amides	2
AcidicOxygens	1
StereoCon

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