| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2012 | 9 | No |
Popular Name: 3-Chloro-2-hydroxypropyltrimethyl ammonium chloride 3-Chloro-2-hydroxypropyltrimethy…
Find On: PubMed — Wikipedia — Google
CAS Number: 3327-22-8
| 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) | 0.21 | 2.34 | -37.68 | 2 | 2 | 1 | 25 | 152.645 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.21 | -0.13 | -3.88 | 1 | 2 | 0 | 23 | 151.637 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0312726A1; EP0312726B1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.