(NE)-N-[(5-bromonaphthalen-2-yl)methylidene]hydroxylamine
Formula:C11H8NOBr
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[(5-bromonaphthalen-2-yl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-[(5-bromonaphthalen-2-yl)methylidene]hydroxylamine |
| MolecularFormula | C11H8NOBr |
| Smiles | O/N=C/c1ccc2c(Br)cccc2c1 |
| InChI | InChI=1S/C11H8BrNO/c12-11-3-1-2-9-6-8(7-13-14)4-5-10(9)11/h1-7,14H |
| InChIK | UTDWXMSDBZEPPF-UHFFFAOYSA-N |
| TotalMolweight | 250.095 |
| Molweight | 250.095 |
| MonoisotopicMass | 248.978925 |
| CLogP | 4.1339 |
| CLogS | -4.755 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 157.6 |
| Relative PSA | 0.15615 |
| PolarSurfaceArea | 32.59 |
| Druglikeness | -2.7413 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 1 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 1 |
| StereoCon |
Click to Load Molecule:
1 - (NE)-N-[(5-bromonaphthalen-2-yl)methylidene]hydroxylamine | 2 - (NE)-N-[(5-bromonaphthalen-2-yl)methylidene]hydroxylamine
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off