| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 20 | Yes |
Popular Name: N-methyl-1-[2-[(4-methylpiperazin-1-yl)methyl]benzofuran-3-yl]methanamine N-methyl-1-[2-[(4-methylpiperazi…
| 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) | 1.68 | 5.84 | -110.85 | 3 | 4 | 2 | 37 | 275.396 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 3.58 | -44.37 | 2 | 4 | 1 | 36 | 274.388 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 5.94 | -100.79 | 3 | 4 | 2 | 37 | 275.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
