| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2009 | 24 | Yes |
Popular Name: (4S)-4-phenyl-2-[2-(4-pyridyl)ethyl]-3,4-dihydro-1H-isoquinoline (4S)-4-phenyl-2-[2-(4-pyridyl)et…
| 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) | 3.63 | 10.51 | -5.65 | 0 | 2 | 0 | 16 | 314.432 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 12.78 | -48.71 | 1 | 2 | 1 | 17 | 315.44 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 10.97 | -35.28 | 1 | 2 | 1 | 17 | 315.44 | 4 | ↓ |
