| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 18 | Yes |
Popular Name: [6-[4-[(1S)-1-methylpropyl]piperazin-1-yl]pyridazin-3-yl]methanamine [6-[4-[(1S)-1-methylpropyl]piper…
| 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) | 0.99 | 4.75 | -90.57 | 4 | 5 | 2 | 61 | 251.378 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 2.89 | -46.56 | 3 | 5 | 1 | 60 | 250.37 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 2.49 | -6.86 | 2 | 5 | 0 | 58 | 249.362 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 4.35 | -40.61 | 3 | 5 | 1 | 59 | 250.37 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
