In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 5th, 2011 | 24 | Yes |
Popular Name: 1-[4-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]piperazin-1-yl]-2-methoxy-ethanone 1-[4-[2-(1-ethylpyrrolo[2,3-b]py…
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) | 1.04 | 9.98 | -58.9 | 1 | 6 | 1 | 52 | 331.44 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.04 | 7.77 | -16.02 | 0 | 6 | 0 | 51 | 330.432 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.