In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 19 | Yes |
Popular Name: (2S)-3-ethyl-N',N'-dimethyl-N-[(3R)-quinuclidin-3-yl]pentane-1,2-diamine (2S)-3-ethyl-N',N'-dimethyl-N-[(…
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) | 2.89 | 9.46 | -90.92 | 3 | 3 | 2 | 21 | 269.477 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.89 | 7.62 | -37.33 | 2 | 3 | 1 | 20 | 268.469 | 7 | ↓ |