| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2008 | 16 | Yes |
Popular Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylamino-propan-2-ol (2S)-1-(3,4-dihydro-1H-isoquinol…
| 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) | 0.87 | 4.66 | -107.66 | 4 | 3 | 2 | 41 | 222.332 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.87 | 0.67 | -3.56 | 2 | 3 | 0 | 35 | 220.316 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.87 | 2.16 | -37.93 | 3 | 3 | 1 | 40 | 221.324 | 4 | ↓ |
