(5Z)-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1-ethyl-1,3-diazinane-2,4,6-trione

Formula:C17H12N2O4Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high (5Z)-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1-ethyl-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5Z)-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1-ethyl-1,3-diazinane-2,4,6-trione
MolecularFormula	C17H12N2O4Cl2
Smiles	CCN(C(/C(/C(N1)=O)=C\c2ccc(-c3cccc(Cl)c3Cl)o2)=O)C1=O
InChI	InChI=1S/C17H12Cl2N2O4/c1-2-21-16(23)11(15(22)20-17(21)24)8-9-6-7-13(25-9)10-4-3-5-12(18)14(10)19/h3-8H,2H2,1H3,(H,20,22,24)
InChIK	ZLFKGPBYTAPONH-UHFFFAOYSA-N
TotalMolweight	379.198
Molweight	379.198
MonoisotopicMass	378.017412
CLogP	3.2174
CLogS	-5.274
H Acceptors	6
H Donors	1
TotalSurfaceArea	265.79
Relative PSA	0.25674
PolarSurfaceArea	79.62
Druglikeness	6.8032
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Amides	2
StereoCon

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