(5E)-1-(4-chlorophenyl)-5-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione

Formula:C21H12N2O4Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high (5E)-1-(4-chlorophenyl)-5-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-1-(4-chlorophenyl)-5-[[5-(2-chlorophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C21H12N2O4Cl2
Smiles	O=C(/C(/C(N1c(cc2)ccc2Cl)=O)=C\c2ccc(-c(cccc3)c3Cl)o2)NC1=O
InChI	InChI=1S/C21H12Cl2N2O4/c22-12-5-7-13(8-6-12)25-20(27)16(19(26)24-21(25)28)11-14-9-10-18(29-14)15-3-1-2-4-17(15)23/h1-11H,(H,24,26,28)
InChIK	CNAAFGVJKQFDFG-UHFFFAOYSA-N
TotalMolweight	427.242
Molweight	427.242
MonoisotopicMass	426.017412
CLogP	4.3063
CLogS	-6.819
H Acceptors	6
H Donors	1
TotalSurfaceArea	299.53
Relative PSA	0.22782
PolarSurfaceArea	79.62
Druglikeness	5.606
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.55172
Fragments	1
Non HAtoms	29
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Symmetricatoms	2
Amides	2
StereoCon

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