N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-(trifluoromethyl)aniline
Formula:C16H13N2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-(trifluoromethyl)aniline is not a drug-like molecule.
| MolName | N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-(trifluoromethyl)aniline |
| MolecularFormula | C16H13N2F3 |
| Smiles | FC(c(cccc1)c1N/N=C(/CC1)\c2c1cccc2)(F)F |
| InChI | InChI=1S/C16H13F3N2/c17-16(18,19)13-7-3-4-8-15(13)21-20-14-10-9-11-5-1-2-6-12(11)14/h1-8,21H,9-10H2 |
| InChIK | YLMLZGGSGCGINZ-UHFFFAOYSA-N |
| TotalMolweight | 290.287 |
| Molweight | 290.287 |
| MonoisotopicMass | 290.103082 |
| CLogP | 6.0199 |
| CLogS | -4.606 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 210.93 |
| Relative PSA | 0.1089 |
| PolarSurfaceArea | 24.39 |
| Druglikeness | -6.8752 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52381 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-(trifluoromethyl)aniline | 2 - N-[(Z)-2,3-dihydroinden-1-ylideneamino]-2-(trifluoromethyl)aniline
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