| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 17 | Yes |
Popular Name: (1S,2S)-N1,N2-diethyl-N2-(2-methoxyethyl)cycloheptane-1,2-diamine (1S,2S)-N1,N2-diethyl-N2-(2-meth…
| 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) | 2.76 | 5.27 | -29.69 | 2 | 3 | 1 | 29 | 243.415 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 4.41 | -1.16 | 1 | 3 | 0 | 24 | 242.407 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.76 | 6.53 | -26.47 | 2 | 3 | 1 | 26 | 243.415 | 7 | ↓ |
