| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 26 | Yes |
Popular Name: 2-(4-butylpiperazin-1-yl)-N-[(1-propylindazol-3-yl)methyl]ethanamine 2-(4-butylpiperazin-1-yl)-N-[(1-…
| 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) | 3.73 | 9.73 | -98.43 | 3 | 5 | 2 | 42 | 359.562 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 7.46 | -43.19 | 2 | 5 | 1 | 41 | 358.554 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 6.09 | -6.55 | 1 | 5 | 0 | 36 | 357.546 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 8.36 | -38.65 | 2 | 5 | 1 | 38 | 358.554 | 10 | ↓ |
