(Z)-3-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]oxy]-2-(2,4-dichlorophenyl)prop-2-enenitrile

Formula:C19H7N3OCl2F6 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-3-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]oxy]-2-(2,4-dichlorophenyl)prop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-3-[[5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-yl]oxy]-2-(2,4-dichlorophenyl)prop-2-enenitrile
MolecularFormula	C19H7N3OCl2F6
Smiles	N#C/C(/c(ccc(Cl)c1)c1Cl)=C\Oc1nc2nc(C(F)(F)F)cc(C(F)(F)F)c2cc1
InChI	InChI=1S/C19H7Cl2F6N3O/c20-10-1-2-11(14(21)5-10)9(7-28)8-31-16-4-3-12-13(18(22,23)24)6-15(19(25,26)27)29-17(12)30-16/h1-6,8H
InChIK	BSBCFSSKXMBAOP-UHFFFAOYSA-N
TotalMolweight	478.179
Molweight	478.179
MonoisotopicMass	476.987034
CLogP	5.6983
CLogS	-7.866
H Acceptors	4
TotalSurfaceArea	311.32
Relative PSA	0.14615
PolarSurfaceArea	58.8
Druglikeness	-12.745
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	3
Symmetricatoms	4
Aromatic Nitrogens	2
StereoCon

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