[(E)-[amino-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]amino] 2,2,3,3,4,4,4-heptafluorobutanoate

Formula:C17H8N3O3ClF10 Mutagenic:high Tumorigenic:high Reproductive Effective:low [(E)-[amino-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]amino] 2,2,3,3,4,4,4-heptafluorobutanoate is not a drug-like molecule.

MolName	[(E)-[amino-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]amino] 2,2,3,3,4,4,4-heptafluorobutanoate
MolecularFormula	C17H8N3O3ClF10
Smiles	N/C(/c(cc1)ccc1Oc(ncc(C(F)(F)F)c1)c1Cl)=N/OC(C(C(C(F)(F)F)(F)F)(F)F)=O
InChI	InChI=1S/C17H8ClF10N3O3/c18-10-5-8(15(21,22)23)6-30-12(10)33-9-3-1-7(2-4-9)11(29)31-34-13(32)14(19,20)16(24,25)17(26,27)28/h1-6H,(H2,29,31)
InChIK	FACLIPFWSHQENN-UHFFFAOYSA-N
TotalMolweight	527.702
Molweight	527.702
MonoisotopicMass	527.009449
CLogP	5.731
CLogS	-8.083
H Acceptors	6
H Donors	1
TotalSurfaceArea	321.58
Relative PSA	0.22013
PolarSurfaceArea	86.8
Druglikeness	-102.69
Mutagenic	high
Tumorigenic	high
Reproductive Effective	low
Irritant	high
Nasty Functions
Shape Index	0.55882
Fragments	1
Non HAtoms	34
NonCHAtoms	17
Electronegative Atoms	17
Rotatable Bond	9
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	8
Aromatic Nitrogens	1
StereoCon

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1 - [(E)-[amino-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]amino] 2,2,3,3,4,4,4-heptafluorobutanoate | 2 - [(E)-[amino-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyphenyl]methylidene]amino] 2,2,3,3,4,4,4-heptafluorobutanoate

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