| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 3rd, 2009 | 24 | Yes |
Popular Name: (2S)-1-[(3,4-dichlorophenyl)methylamino]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol (2S)-1-[(3,4-dichlorophenyl)meth…
| 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) | 3.56 | 9.26 | -128.12 | 4 | 3 | 2 | 41 | 367.32 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.56 | 5.34 | -7.39 | 2 | 3 | 0 | 35 | 365.304 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.56 | 6.85 | -58.56 | 3 | 3 | 1 | 40 | 366.312 | 6 | ↓ |
