In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 25 | Yes |
Popular Name: 3-isobutyl-2-oxo-1-[(2S)-2-pyrrolidin-1-ylpropyl]imidazo[4,5-b]pyridine-6-carboxylic 3-isobutyl-2-oxo-1-[(2S)-2-pyrro…
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) | 1.75 | 10.85 | -53.46 | 1 | 7 | 0 | 84 | 346.431 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.75 | 8.62 | -43.51 | 0 | 7 | -1 | 83 | 345.423 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.