In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 20 | Yes |
Popular Name: (7S,8S)-N7-cycloheptyl-N7-methyl-1,4-dioxaspiro[4.5]decane-7,8-diamine (7S,8S)-N7-cycloheptyl-N7-methyl…
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) | 2.15 | 5.28 | -122.44 | 4 | 4 | 2 | 51 | 284.444 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 3.37 | -41.48 | 3 | 4 | 1 | 49 | 283.436 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 4.98 | -32.59 | 3 | 4 | 1 | 49 | 283.436 | 2 | ↓ |