| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 17 | Yes |
Popular Name: (1S,2R,4R)-N2-benzyl-N2,4-dimethyl-cyclohexane-1,2-diamine (1S,2R,4R)-N2-benzyl-N2,4-dimeth…
| 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) | 2.01 | 7.7 | -122.88 | 4 | 2 | 2 | 32 | 234.387 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 7.44 | -33.37 | 3 | 2 | 1 | 30 | 233.379 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 5.57 | -41.22 | 3 | 2 | 1 | 31 | 233.379 | 3 | ↓ |
