| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | Yes |
Popular Name: 3-(4-methylpiperazin-1-yl)-N-[(1S)-1-phenylethyl]propan-1-amine 3-(4-methylpiperazin-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) | 2.25 | 7.62 | -89.5 | 3 | 3 | 2 | 24 | 263.429 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 7.49 | -110.46 | 3 | 3 | 2 | 24 | 263.429 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.25 | 5.15 | -41.58 | 2 | 3 | 1 | 23 | 262.421 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
