| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | Yes |
Popular Name: 1-[(2S,6S)-2,6-dimethylpiperazin-1-yl]-3-(o-tolyl)propan-1-one 1-[(2S,6S)-2,6-dimethylpiperazin…
| 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) | 2.34 | 7.66 | -48.15 | 2 | 3 | 1 | 37 | 261.389 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.34 | 6.5 | -6.03 | 1 | 3 | 0 | 32 | 260.381 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
