| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 15 | Yes |
Popular Name: [5-[(4-methylpiperazin-1-yl)methyl]-3-furyl]methanamine [5-[(4-methylpiperazin-1-yl)meth…
None
| 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) | 0.00 | 1.94 | -93.35 | 4 | 4 | 2 | 48 | 211.309 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.00 | -0.73 | -3.99 | 2 | 4 | 0 | 46 | 209.293 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | -0.32 | -44.7 | 3 | 4 | 1 | 47 | 210.301 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.00 | 2.05 | -88.14 | 4 | 4 | 2 | 48 | 211.309 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
