| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 18 | Yes |
Popular Name: [1-isopropyl-4-(4-methylpiperazin-1-yl)-4-piperidyl]methanamine [1-isopropyl-4-(4-methylpiperazi…
| 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) | 0.20 | 4.24 | -178.45 | 5 | 4 | 3 | 40 | 257.446 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.20 | 1.74 | -31.12 | 3 | 4 | 1 | 37 | 255.43 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.20 | 2.1 | -105.85 | 4 | 4 | 2 | 39 | 256.438 | 3 | ↓ |
