| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: (1S,2R,4R)-N2-[(1S)-1,2-dimethylpropyl]-N1,N2-dimethyl-4-phenyl-cyclohexane-1,2-diamine (1S,2R,4R)-N2-[(1S)-1,2-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) | 4.30 | 10.3 | -117.53 | 3 | 2 | 2 | 21 | 290.495 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.30 | 9.34 | -37.18 | 2 | 2 | 1 | 20 | 289.487 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.30 | 9.4 | -33.28 | 2 | 2 | 1 | 16 | 289.487 | 5 | ↓ |
