| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 21 | Yes |
Popular Name: 1-[(2S,6S)-2,6-dimethylpiperazin-1-yl]-3-(1H-indol-3-yl)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) | 2.09 | 7.22 | -48.97 | 3 | 4 | 1 | 53 | 286.399 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.09 | 5.9 | -8.79 | 2 | 4 | 0 | 48 | 285.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
