| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2008 | 20 | Yes |
Popular Name: (1S)-1-(o-tolyl)-2-[(1R,5S)-3,3,5-trimethylcyclohexoxy]ethanamine (1S)-1-(o-tolyl)-2-[(1R,5S)-3,3,…
| 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) | 2.38 | 8.58 | -45.23 | 3 | 2 | 1 | 37 | 276.444 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.38 | 8.26 | -1.9 | 2 | 2 | 0 | 35 | 275.436 | 4 | ↓ |
