| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 21 | Yes |
Popular Name: (1S,2R,4R)-N2-isobutyl-N2-isopropyl-4-phenyl-cyclohexane-1,2-diamine (1S,2R,4R)-N2-isobutyl-N2-isopro…
| 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) | 3.73 | 9.89 | -122.73 | 4 | 2 | 2 | 32 | 290.495 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 8.25 | -41.63 | 3 | 2 | 1 | 31 | 289.487 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 9.61 | -30.69 | 3 | 2 | 1 | 30 | 289.487 | 5 | ↓ |
