(5E)-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione

Formula:C13H8N2O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione is a drug-like molecule.

MolName	(5E)-5-[(3,5-dichloro-4-prop-2-ynoxyphenyl)methylidene]imidazolidine-2,4-dione
MolecularFormula	C13H8N2O3Cl2
Smiles	C#CCOc(c(Cl)cc(/C=C(\C(N1)=O)/NC1=O)c1)c1Cl
InChI	InChI=1S/C13H8Cl2N2O3/c1-2-3-20-11-8(14)4-7(5-9(11)15)6-10-12(18)17-13(19)16-10/h1,4-6H,3H2,(H2,16,17,18,19)
InChIK	WTLXWJLEQFYNGM-UHFFFAOYSA-N
TotalMolweight	311.124
Molweight	311.124
MonoisotopicMass	309.991197
CLogP	2.0375
CLogS	-4.85
H Acceptors	5
H Donors	2
TotalSurfaceArea	221.3
Relative PSA	0.26661
PolarSurfaceArea	67.43
Druglikeness	3.0715
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! 5-methylene-imidazolidine-2,4-dione
Shape Index	0.65
Fragments	1
Non HAtoms	20
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	2
Symmetricatoms	3
Amides	2
StereoCon

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