| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | Yes |
Popular Name: 1-[(2-chloro-3-pyridyl)methyl]-4-[(1S)-1-methylpropyl]piperazine 1-[(2-chloro-3-pyridyl)methyl]-4…
| 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) | 2.57 | 6.29 | -34.73 | 1 | 3 | 1 | 21 | 268.812 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.57 | 4.39 | -4.85 | 0 | 3 | 0 | 19 | 267.804 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
