| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-N2,N2-bis(2-methoxyethyl)-N1-propyl-cyclooctane-1,2-diamine (1R,2S)-N2,N2-bis(2-methoxyethyl…
| 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) | 3.37 | 5.28 | -29.28 | 2 | 4 | 1 | 38 | 301.495 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 4.44 | -1.65 | 1 | 4 | 0 | 34 | 300.487 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 6.38 | -31.44 | 2 | 4 | 1 | 35 | 301.495 | 10 | ↓ |
