| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 21 | Yes |
Popular Name: (1S,2R,4R)-N2-[(1R)-1,3-dimethylbutyl]-N2-methyl-4-phenyl-cyclohexane-1,2-diamine (1S,2R,4R)-N2-[(1R)-1,3-dimethyl…
| 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) | 3.92 | 9.96 | -126.21 | 4 | 2 | 2 | 32 | 290.495 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.92 | 8.32 | -43.6 | 3 | 2 | 1 | 31 | 289.487 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.92 | 9.7 | -32.85 | 3 | 2 | 1 | 30 | 289.487 | 5 | ↓ |
