| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 21 | No |
Popular Name: 2-[[4-(2-aminoethyl)-1-piperidyl]methyl]isoindoline-1,3-dione 2-[[4-(2-aminoethyl)-1-piperidyl…
| 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) | 1.57 | 3.87 | -49.67 | 3 | 5 | 1 | 70 | 288.371 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.57 | 6.2 | -93.26 | 4 | 5 | 2 | 71 | 289.379 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
