In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (7R,8S)-N7-[(1S)-1-cyclopropylethyl]-N7,N8-dimethyl-1,4-dioxaspiro[4.5]decane-7,8-diamine (7R,8S)-N7-[(1S)-1-cyclopropylet…
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) | 1.85 | 5.46 | -31.91 | 2 | 4 | 1 | 35 | 269.409 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 3.89 | -2.28 | 1 | 4 | 0 | 34 | 268.401 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 4.66 | -34.64 | 2 | 4 | 1 | 38 | 269.409 | 4 | ↓ |