In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2009 | 21 | Yes |
Popular Name: 4-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-2,2-diethyl-4-oxo-butanoic 4-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-o…
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) | 3.29 | 10.12 | -61.49 | 0 | 4 | -1 | 60 | 294.415 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.29 | 8.15 | -13.17 | 1 | 4 | 0 | 58 | 295.423 | 5 | ↓ |