| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 19 | Yes |
Popular Name: (3S)-1-[3-(hydroxymethyl)-1-isoquinolyl]piperidin-3-ol (3S)-1-[3-(hydroxymethyl)-1-isoq…
| 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) | 1.83 | 3.24 | -25.12 | 3 | 4 | 1 | 58 | 259.329 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 2.81 | -8.21 | 2 | 4 | 0 | 57 | 258.321 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
