| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2010 | 21 | Yes |
Popular Name: 2-bromo-6-[[2-(1H-indol-3-yl)ethylamino]methyl]phenol 2-bromo-6-[[2-(1H-indol-3-yl)eth…
| 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) | 3.95 | 6.99 | -46.35 | 4 | 3 | 1 | 53 | 346.248 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 7.73 | -36.36 | 3 | 3 | 0 | 55 | 345.24 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.95 | 6.35 | -46.06 | 2 | 3 | -1 | 51 | 344.232 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.95 | 5.59 | -8.35 | 3 | 3 | 0 | 48 | 345.24 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![Benzyl-[2-(1H-indol-3-yl)ethyl]amine](http://zinc12.docking.org/img/rings/13515.gif)