| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 21 | Yes |
Popular Name: N-methyl-1-[2-[[4-(2-pyridyl)piperazin-1-yl]methyl]-3-furyl]methanamine N-methyl-1-[2-[[4-(2-pyridyl)pip…
| 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) | 1.18 | 5.65 | -84.17 | 3 | 5 | 2 | 50 | 288.395 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.18 | 5.33 | -43.49 | 2 | 5 | 1 | 49 | 287.387 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 7.57 | -109.96 | 3 | 5 | 2 | 50 | 288.395 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 7.88 | -182.35 | 4 | 5 | 3 | 52 | 289.403 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
