| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 20 | Yes |
Popular Name: [(2S,6R)-2,6-dimethylpiperazin-1-yl]-[(1S)-isochroman-1-yl]methanone [(2S,6R)-2,6-dimethylpiperazin-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) | 1.18 | 5.94 | -57.8 | 2 | 4 | 1 | 46 | 275.372 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 4.63 | -10.68 | 1 | 4 | 0 | 42 | 274.364 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
