| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 16 | Yes |
Popular Name: (4,6-dimethyl-2-piperazin-1-yl-3-pyridyl)methanamine (4,6-dimethyl-2-piperazin-1-yl-3…
| 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) | 0.39 | 3.71 | -184.37 | 6 | 4 | 3 | 62 | 223.344 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 2.4 | -95.13 | 5 | 4 | 2 | 57 | 222.336 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 2.04 | -23.15 | 4 | 4 | 1 | 55 | 221.328 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.39 | 3.26 | -106.77 | 5 | 4 | 2 | 60 | 222.336 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
