In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 19 | Yes |
Popular Name: (4-amino-2-pyridyl)-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]methanone (4-amino-2-pyridyl)-[(3R)-3-pyrr…
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) | 0.17 | 4.89 | -39.82 | 3 | 5 | 1 | 64 | 261.349 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.17 | 5.03 | -87.9 | 4 | 5 | 2 | 65 | 262.357 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.