In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 19 | Yes |
Popular Name: (7S,8S)-N7-cyclopentyl-N7-ethyl-1,4-dioxaspiro[4.5]decane-7,8-diamine (7S,8S)-N7-cyclopentyl-N7-ethyl-…
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) | 1.52 | 4.89 | -117.23 | 4 | 4 | 2 | 51 | 270.417 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 3.2 | -41.7 | 3 | 4 | 1 | 49 | 269.409 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.52 | 4.57 | -29.47 | 3 | 4 | 1 | 49 | 269.409 | 3 | ↓ |