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

Formula:C22H14N2O4Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high (5Z)-1-benzyl-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5Z)-1-benzyl-5-[[5-(2,3-dichlorophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C22H14N2O4Cl2
Smiles	O=C(/C(/C(N1Cc2ccccc2)=O)=C/c2ccc(-c3cccc(Cl)c3Cl)o2)NC1=O
InChI	InChI=1S/C22H14Cl2N2O4/c23-17-8-4-7-15(19(17)24)18-10-9-14(30-18)11-16-20(27)25-22(29)26(21(16)28)12-13-5-2-1-3-6-13/h1-11H,12H2,(H,25,27,29)
InChIK	WPMUVFPGHHFTAS-UHFFFAOYSA-N
TotalMolweight	441.269
Molweight	441.269
MonoisotopicMass	440.033062
CLogP	4.2292
CLogS	-6.297
H Acceptors	6
H Donors	1
TotalSurfaceArea	313.29
Relative PSA	0.21782
PolarSurfaceArea	79.62
Druglikeness	6.5754
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	2
Amides	2
StereoCon

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