| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 20 | Yes |
Popular Name: 1-isopropyl-N-[3-(4-methylpiperazin-1-yl)propyl]piperidin-4-amine 1-isopropyl-N-[3-(4-methylpipera…
| 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) | 1.38 | 4.96 | -88.69 | 3 | 4 | 2 | 28 | 284.492 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 4.83 | -108.77 | 3 | 4 | 2 | 28 | 284.492 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 2.49 | -40.87 | 2 | 4 | 1 | 26 | 283.484 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.38 | 7.21 | -163.3 | 4 | 4 | 3 | 29 | 285.5 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
