(NZ)-N-[(4Z)-8-(benzimidazol-1-yl)cyclooct-4-en-1-ylidene]hydroxylamine
Formula:C15H17N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(4Z)-8-(benzimidazol-1-yl)cyclooct-4-en-1-ylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(4Z)-8-(benzimidazol-1-yl)cyclooct-4-en-1-ylidene]hydroxylamine |
| MolecularFormula | C15H17N3O |
| Smiles | O/N=C(/CC/C=C\CC1)\C1n1c(cccc2)c2nc1 |
| InChI | InChI=1S/C15H17N3O/c19-17-13-8-3-1-2-4-9-15(13)18-11-16-12-7-5-6-10-14(12)18/h1-2,5-7,10-11,15,19H,3-4,8-9H2/t15-/m0/s1 |
| InChIK | SDRNYHVLADJMFA-HNNXBMFYSA-N |
| TotalMolweight | 255.32 |
| Molweight | 255.32 |
| MonoisotopicMass | 255.137162 |
| CLogP | 3.6552 |
| CLogS | -2.645 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 205.68 |
| Relative PSA | 0.20639 |
| PolarSurfaceArea | 50.41 |
| Druglikeness | -3.5304 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52632 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 9 |
| Sp3Atoms | 6 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon | racemate |
Click to Load Molecule:
1 - (NZ)-N-[(4Z)-8-(benzimidazol-1-yl)cyclooct-4-en-1-ylidene]hydroxylamine | 2 - (NZ)-N-[(4Z)-8-(benzimidazol-1-yl)cyclooct-4-en-1-ylidene]hydroxylamine
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off