| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 19 | Yes |
Popular Name: (3R)-3-[4-(4-pyridylmethyl)piperazin-1-yl]pentan-1-amine (3R)-3-[4-(4-pyridylmethyl)piper…
| 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) | 0.28 | 3.66 | -110.96 | 4 | 4 | 2 | 48 | 264.417 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.28 | 1.4 | -3.88 | 2 | 4 | 0 | 45 | 262.401 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 4.07 | -100.95 | 4 | 4 | 2 | 48 | 264.417 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 1.79 | -44.92 | 3 | 4 | 1 | 47 | 263.409 | 6 | ↓ |
