| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 12th, 2011 | 15 | No |
Popular Name: (R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene (R)-((2-(Bromomethyl)-3-methylbu…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 172901-00-7 , 179993-02-3
| 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 | 8.36 | -3.18 | 0 | 1 | 0 | 9 | 271.198 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5641778 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.