| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 22 | No |
Popular Name: Octadecyl trimethyl ammonium bromide Octadecyl trimethyl ammonium bro…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 112-03-8 , [112-03-8] , [1120-02-1]
1-Octadecanaminium, N,N,N-trimethyl-, chloride; 112-03-8; C18371; Stearyltrimethylammonium chloride
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.88 | 17.81 | -28.79 | 0 | 1 | 1 | 0 | 312.606 | 17 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DYN1-1-E | Dynamin-1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 3150 | 0.35 | Binding ≤ 10μM |
| Z50425-6-O | Plasmodium Falciparum (cluster #6 Of 22), Other | Other | 2100 | 0.36 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DYN1_HUMAN | Q05193 | Dynamin-1, Human | 3150 | 0.35 | Binding ≤ 10μM |
| Z50425 | Z50425 | Plasmodium Falciparum | 2100 | 0.36 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| EPH-ephrin mediated repulsion of cells | |
| Formation of annular gap junctions | |
| Gap junction degradation | |
| MHC class II antigen presentation | |
| Recycling pathway of L1 | |
| Retrograde neurotrophin signalling | |
| Toll Like Receptor 4 (TLR4) Cascade |
