| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 20 | Yes |
Popular Name: N-methyl-1-[1-(4-methylphthalazin-1-yl)-4-piperidyl]methanamine N-methyl-1-[1-(4-methylphthalazi…
| 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) | 2.74 | 8.2 | -78.73 | 3 | 4 | 2 | 47 | 272.396 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.74 | 8.05 | -47.02 | 2 | 4 | 1 | 46 | 271.388 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.74 | 8.17 | -77.04 | 3 | 4 | 2 | 47 | 272.396 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.74 | 8.31 | -161.17 | 4 | 4 | 3 | 48 | 273.404 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
