2,6-dichloro-N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-4-(trifluoromethyl)aniline

Formula:C17H13N2Cl2F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2,6-dichloro-N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-4-(trifluoromethyl)aniline is not a drug-like molecule.

MolName2,6-dichloro-N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-4-(trifluoromethyl)aniline
MolecularFormulaC17H13N2Cl2F3
SmilesFC(c(cc1Cl)cc(Cl)c1N/N=C(\CCC1)/c2c1cccc2)(F)F
InChIInChI=1S/C17H13Cl2F3N2/c18-13-8-11(17(20,21)22)9-14(19)16(13)24-23-15-7-3-5-10-4-1-2-6-12(10)15/h1-2,4,6,8-9,24H,3,5,7H2
InChIKLOGJDNRPTIDJEH-UHFFFAOYSA-N
TotalMolweight373.204
Molweight373.204
MonoisotopicMass372.040786
CLogP7.5739
CLogS-6.348
H Acceptors2
H Donors1
TotalSurfaceArea255.53
Relative PSA0.089892
PolarSurfaceArea24.39
Druglikeness-8.7234
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.54167
Fragments1
Non HAtoms24
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms5
StereoCon

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