(4Z)-4-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one

Formula:C18H11NO3Br2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (4Z)-4-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-4-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one
MolecularFormula	C18H11NO3Br2
Smiles	Oc(c(/C=C1\N=C(/C=C/c2ccccc2)OC1=O)cc(Br)c1)c1Br
InChI	InChI=1S/C18H11Br2NO3/c19-13-8-12(17(22)14(20)10-13)9-15-18(23)24-16(21-15)7-6-11-4-2-1-3-5-11/h1-10,22H
InChIK	VKNPFBADBFVTEX-UHFFFAOYSA-N
TotalMolweight	449.097
Molweight	449.097
MonoisotopicMass	446.910566
CLogP	4.051
CLogS	-5.661
H Acceptors	4
H Donors	1
TotalSurfaceArea	265.06
Relative PSA	0.17977
PolarSurfaceArea	58.89
Druglikeness	-0.83916
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
StereoCon

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1 - (4Z)-4-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one | 2 - (4Z)-4-[(3,5-dibromo-2-hydroxyphenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one

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