In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 17 | Yes |
Popular Name: 4-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-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) | 1.62 | 7.42 | -46.48 | 0 | 4 | -1 | 60 | 238.307 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.62 | 5.45 | -7.16 | 1 | 4 | 0 | 58 | 239.315 | 3 | ↓ |