In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2010 | 21 | Yes |
Popular Name: N-[[1-(4-methylphthalazin-1-yl)-4-piperidyl]methyl]ethanamine N-[[1-(4-methylphthalazin-1-yl)-…
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) | 2.77 | 9.05 | -78.52 | 3 | 4 | 2 | 47 | 286.423 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 8.92 | -45.98 | 2 | 4 | 1 | 46 | 285.415 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.77 | 9.03 | -76.65 | 3 | 4 | 2 | 47 | 286.423 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.77 | 9.17 | -161.68 | 4 | 4 | 3 | 48 | 287.431 | 4 | ↓ |