| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2009 | 18 | Yes |
Popular Name: (2R)-2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-(3-thienyl)ethanamine (2R)-2-[(4aR,8aS)-3,4,4a,5,6,7,8…
| 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) | 2.49 | 7.27 | -122.5 | 4 | 2 | 2 | 32 | 266.454 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 5.26 | -1.53 | 2 | 2 | 0 | 29 | 264.438 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 7.29 | -27.55 | 3 | 2 | 1 | 30 | 265.446 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 5.54 | -47.42 | 3 | 2 | 1 | 31 | 265.446 | 3 | ↓ |
