| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2005 | 16 | Yes |
Popular Name: LS-42733 LS-42733
Find On: PubMed — Wikipedia — Google
CAS Numbers: 119802-68-5 , 1215071-07-0
3-Chloro-alpha-[1-[ amino]ethyl]benzenemethanol
3-Chloro-α-[1-[(1,1-dimethylethyl)amino]ethyl]benzenemethanol
| 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) | 3.08 | -1.57 | -36.25 | 3 | 2 | 1 | 36 | 242.77 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Indications | antidepressant | KeyOrganics Bioactives |
No pre-computed analogs available. Try a structural similarity search.