| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 24 | Yes |
Popular Name: (2R)-2-methoxy-N-[5-(1-piperidyl)-8-isoquinolyl]butanamide (2R)-2-methoxy-N-[5-(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) | 2.99 | 8.6 | -10.48 | 1 | 5 | 0 | 54 | 327.428 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 9.08 | -44.12 | 2 | 5 | 1 | 56 | 328.436 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 9.03 | -99.88 | 3 | 5 | 2 | 57 | 329.444 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
