| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 19 | Yes |
Popular Name: N-[(1R,2S)-1-(aminomethyl)-2-methyl-cyclohexyl]-N-isobutyl-N',N'-dimethyl-ethane-1,2-diamine N-[(1R,2S)-1-(aminomethyl)-2-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) | 2.52 | 6.48 | -112.91 | 4 | 3 | 2 | 35 | 271.493 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 5.12 | -116.21 | 4 | 3 | 2 | 35 | 271.493 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 3.9 | -44.65 | 3 | 3 | 1 | 34 | 270.485 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.52 | 7.61 | -219.92 | 5 | 3 | 3 | 37 | 272.501 | 7 | ↓ |
