(4Z)-2-(3-chlorophenyl)-4-[(5-iodofuran-2-yl)methylidene]-1,3-oxazol-5-one

Formula:C14H7NO3ClI Mutagenic:high Tumorigenic:high Reproductive Effective:none (4Z)-2-(3-chlorophenyl)-4-[(5-iodofuran-2-yl)methylidene]-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-2-(3-chlorophenyl)-4-[(5-iodofuran-2-yl)methylidene]-1,3-oxazol-5-one
MolecularFormula	C14H7NO3ClI
Smiles	O=C1OC(c2cc(Cl)ccc2)=N/C1=C\c(o1)ccc1I
InChI	InChI=1S/C14H7ClINO3/c15-9-3-1-2-8(6-9)13-17-11(14(18)20-13)7-10-4-5-12(16)19-10/h1-7H
InChIK	JEKYPIIDDTZJKH-UHFFFAOYSA-N
TotalMolweight	399.567
Molweight	399.567
MonoisotopicMass	398.915919
CLogP	2.921
CLogS	-5.116
H Acceptors	4
TotalSurfaceArea	226.34
Relative PSA	0.21499
PolarSurfaceArea	51.8
Druglikeness	2.48
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
StereoCon

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