| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 20 | Yes |
Popular Name: N-[(1S)-1-(2-chlorophenyl)ethyl]-3-(4-methylpiperazin-1-yl)propan-1-amine N-[(1S)-1-(2-chlorophenyl)ethyl]…
| 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) | 2.88 | 8.09 | -91.5 | 3 | 3 | 2 | 24 | 297.874 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.88 | 4.34 | -3.12 | 1 | 3 | 0 | 19 | 295.858 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 7.96 | -112.88 | 3 | 3 | 2 | 24 | 297.874 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 5.62 | -42.78 | 2 | 3 | 1 | 23 | 296.866 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
