In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 34 | Yes |
Popular Name: 3,4-dihydro-1H-isoquinolin-2-yl-(hydroxyBLAHyl)methanone 3,4-dihydro-1H-isoquinolin-2-yl-…
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) | 4.10 | 11.69 | -48.08 | 3 | 5 | 1 | 61 | 456.61 | 1 | ↓ |
Hi High (pH 8-9.5) | 4.10 | 9.56 | -13.42 | 2 | 5 | 0 | 60 | 455.602 | 1 | ↓ |