In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2011 | 20 | Yes |
Popular Name: 2-methyl-1-[(3S)-3-(3-methylimidazo[4,5-b]pyridin-2-yl)pyrrolidin-1-yl]propan-1-one 2-methyl-1-[(3S)-3-(3-methylimid…
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) | 1.28 | 7.27 | -15.89 | 0 | 5 | 0 | 51 | 272.352 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 7.8 | -36.1 | 1 | 5 | 1 | 52 | 273.36 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.