In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 21 | Yes |
Popular Name: 2-(8-azaspiro[4.5]decan-8-yl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone 2-(8-azaspiro[4.5]decan-8-yl)-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) | 2.73 | 11.24 | -35.1 | 1 | 3 | 1 | 26 | 289.443 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 9.05 | -7.24 | 0 | 3 | 0 | 25 | 288.435 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.