| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 16 | Yes |
Popular Name: (1S,2R,4R)-N1,N2,4-trimethyl-N2-[(1S)-1-methylbutyl]cyclohexane-1,2-diamine (1S,2R,4R)-N1,N2,4-trimethyl-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) | 3.29 | 7.01 | -30.56 | 2 | 2 | 1 | 16 | 227.416 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.29 | 6.2 | -32.49 | 2 | 2 | 1 | 20 | 227.416 | 5 | ↓ |
