| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 20 | Yes |
Popular Name: 2-[1-[(2-methyl-1H-indol-3-yl)methyl]-4-piperidyl]ethanamine 2-[1-[(2-methyl-1H-indol-3-yl)me…
| 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) | 2.14 | 7.38 | -96.6 | 5 | 3 | 2 | 48 | 273.424 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 5.14 | -45.97 | 4 | 3 | 1 | 47 | 272.416 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
