| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 21 | Yes |
Popular Name: 4-[(1R)-1-hydroxy-2-[[(1S,3R)-1-(hydroxymethyl)-3-methyl-cyclohexyl]amino]ethyl]benzonitrile 4-[(1R)-1-hydroxy-2-[[(1S,3R)-1-…
| 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) | 2.02 | 3.35 | -46.33 | 4 | 4 | 1 | 81 | 289.399 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 2.14 | -7.91 | 3 | 4 | 0 | 76 | 288.391 | 5 | ↓ |
