| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: 3-[4-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]piperazin-1-yl]propan-1-amine 3-[4-[(4-methoxy-3,5-dimethyl-2-…
| 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) | 0.74 | 3.62 | -91.83 | 4 | 5 | 2 | 57 | 294.443 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.74 | 1.69 | -80.71 | 4 | 5 | 2 | 57 | 294.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 3.59 | -107.75 | 4 | 5 | 2 | 57 | 294.443 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 3.97 | -167.5 | 5 | 5 | 3 | 59 | 295.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 1.33 | -46.13 | 3 | 5 | 1 | 56 | 293.435 | 6 | ↓ |
