In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2011 | 14 | Yes |
Popular Name: 2-[(4aS,7R,7aS)-2-oxo-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-7-yl]acetic 2-[(4aS,7R,7aS)-2-oxo-1,3,4,4a,5…
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) | 0.47 | 3.74 | -47.66 | 1 | 4 | -1 | 69 | 196.226 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.47 | 1.78 | -10.53 | 2 | 4 | 0 | 66 | 197.234 | 2 | ↓ |