| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 13 | Yes |
Popular Name: (1R,2S)-N1-methyl-N1-[(1R)-1-methylpropyl]cyclohexane-1,2-diamine (1R,2S)-N1-methyl-N1-[(1R)-1-met…
| 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) | 1.81 | 5.26 | -110.07 | 4 | 2 | 2 | 32 | 186.343 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 3.51 | -36.84 | 3 | 2 | 1 | 31 | 185.335 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 5.02 | -28.49 | 3 | 2 | 1 | 30 | 185.335 | 3 | ↓ |
