In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: 4-(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butanoic 4-(7-hydroxy-3,4-dihydro-1H-isoq…
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) | 0.34 | 4.44 | -47.28 | 1 | 5 | -1 | 81 | 248.258 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.34 | 2.46 | -10.22 | 2 | 5 | 0 | 78 | 249.266 | 3 | ↓ |