In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 20 | Yes |
Popular Name: (8S,9S)-N8,N9-diethyl-N9-(2-methoxyethyl)-1,4-dioxaspiro[4.5]decane-8,9-diamine (8S,9S)-N8,N9-diethyl-N9-(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) | 1.39 | 3.23 | -33.41 | 2 | 5 | 1 | 48 | 287.424 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 6.2 | -28.61 | 2 | 5 | 1 | 44 | 287.424 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 1.63 | -3.95 | 1 | 5 | 0 | 43 | 286.416 | 7 | ↓ |