| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | Yes |
Popular Name: [(2S,6S)-2,6-dimethylpiperazin-1-yl]-(1H-indol-5-yl)methanone [(2S,6S)-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) | 1.06 | 5.28 | -54.49 | 3 | 4 | 1 | 53 | 258.345 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 3.95 | -10.9 | 2 | 4 | 0 | 48 | 257.337 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
