(NZ)-N-[2-(benzimidazol-1-yl)cyclododecylidene]hydroxylamine
Formula:C19H27N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[2-(benzimidazol-1-yl)cyclododecylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[2-(benzimidazol-1-yl)cyclododecylidene]hydroxylamine |
| MolecularFormula | C19H27N3O |
| Smiles | O/N=C(/CCCCCCCCCC1)\C1n1c(cccc2)c2nc1 |
| InChI | InChI=1S/C19H27N3O/c23-21-17-12-7-5-3-1-2-4-6-8-13-19(17)22-15-20-16-11-9-10-14-18(16)22/h9-11,14-15,19,23H,1-8,12-13H2/t19-/m0/s1 |
| InChIK | GQYSIHBPUVRNGW-IBGZPJMESA-N |
| TotalMolweight | 313.443 |
| Molweight | 313.443 |
| MonoisotopicMass | 313.215412 |
| CLogP | 5.725 |
| CLogS | -3.953 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 261.74 |
| Relative PSA | 0.16218 |
| PolarSurfaceArea | 50.41 |
| Druglikeness | -3.6345 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.52174 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 1 |
| Rotatable Bond | 1 |
| Rings Closures | 3 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 9 |
| Sp3Atoms | 12 |
| Aromatic Nitrogens | 2 |
| BasicNitrogens | 1 |
| StereoCon | racemate |
Click to Load Molecule:
1 - (NZ)-N-[2-(benzimidazol-1-yl)cyclododecylidene]hydroxylamine | 2 - (NZ)-N-[2-(benzimidazol-1-yl)cyclododecylidene]hydroxylamine
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off