| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 21 | Yes |
Popular Name: (1S,2R,4R)-N2-methyl-4-phenyl-N2-[(1S)-1,2,2-trimethylpropyl]cyclohexane-1,2-diamine (1S,2R,4R)-N2-methyl-4-phenyl-N2…
| 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) | 3.97 | 9.6 | -121.36 | 4 | 2 | 2 | 32 | 290.495 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 9.33 | -31.12 | 3 | 2 | 1 | 30 | 289.487 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 8.27 | -41.88 | 3 | 2 | 1 | 31 | 289.487 | 4 | ↓ |
