| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 16 | Yes |
Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]pyridazin-3-amine N-[2-(4-methylpiperazin-1-yl)eth…
| 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) | 0.11 | 2.77 | -45.85 | 2 | 5 | 1 | 45 | 222.316 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.11 | 0.5 | -7.91 | 1 | 5 | 0 | 44 | 221.308 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.11 | 3.05 | -77.84 | 3 | 5 | 2 | 47 | 223.324 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.11 | 3.04 | -77.93 | 3 | 5 | 2 | 47 | 223.324 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.11 | 2.88 | -42 | 2 | 5 | 1 | 45 | 222.316 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.11 | 2.94 | -90.87 | 3 | 5 | 2 | 47 | 223.324 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
