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

Formula:C27H17NO3Cl2 Mutagenic:high Tumorigenic:none Reproductive Effective:none (4Z)-3-(4-chlorophenyl)-4-[[3-[(2-chlorophenyl)methoxy]naphthalen-2-yl]methylidene]-1,2-oxazol-5-one is not a drug-like molecule.

MolName	(4Z)-3-(4-chlorophenyl)-4-[[3-[(2-chlorophenyl)methoxy]naphthalen-2-yl]methylidene]-1,2-oxazol-5-one
MolecularFormula	C27H17NO3Cl2
Smiles	O=C(/C1=C\c2cc3ccccc3cc2OCc(cccc2)c2Cl)ON=C1c(cc1)ccc1Cl
InChI	InChI=1S/C27H17Cl2NO3/c28-22-11-9-17(10-12-22)26-23(27(31)33-30-26)14-21-13-18-5-1-2-6-19(18)15-25(21)32-16-20-7-3-4-8-24(20)29/h1-15H,16H2
InChIK	TZAAKPMDKWOJPI-UHFFFAOYSA-N
TotalMolweight	474.342
Molweight	474.342
MonoisotopicMass	473.058548
CLogP	7.5452
CLogS	-8.59
H Acceptors	4
TotalSurfaceArea	343.91
Relative PSA	0.12954
PolarSurfaceArea	47.89
Druglikeness	-1.3849
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.48485
Fragments	1
Non HAtoms	33
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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

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