In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2011 | 21 | Yes |
Popular Name: 1-[4-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]piperazin-1-yl]ethanone 1-[4-[2-(1-methylpyrrolo[2,3-b]p…
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) | 0.72 | 8.91 | -54.95 | 1 | 5 | 1 | 43 | 287.387 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.72 | 6.71 | -13.62 | 0 | 5 | 0 | 41 | 286.379 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.