| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 21 | Yes |
Popular Name: 2-[4-(5-amino-2-pyridyl)piperazin-1-yl]-N-isopropyl-N-methyl-acetamide 2-[4-(5-amino-2-pyridyl)piperazi…
| 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) | 0.71 | 6.21 | -91.21 | 4 | 6 | 2 | 68 | 293.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 4.02 | -30.73 | 3 | 6 | 1 | 67 | 292.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 5.9 | -38.8 | 3 | 6 | 1 | 67 | 292.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 3.71 | -10.26 | 2 | 6 | 0 | 66 | 291.399 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
