| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | Yes |
Popular Name: 2-[[4-(aminomethyl)-5,6-dimethyl-pyridazin-3-yl]-methyl-amino]-1-pyrrolidin-1-yl-ethanone 2-[[4-(aminomethyl)-5,6-dimethyl…
| 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) | 0.31 | 4.2 | -31.85 | 3 | 6 | 1 | 77 | 278.38 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.31 | 4.09 | -18.53 | 2 | 6 | 0 | 75 | 277.372 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.31 | 4.38 | -25.81 | 3 | 6 | 1 | 77 | 278.38 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.31 | 4.62 | -115.45 | 4 | 6 | 2 | 78 | 279.388 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.31 | 4.81 | -114.15 | 4 | 6 | 2 | 78 | 279.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
