In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 19 | No |
Popular Name: 3-[(3S)-quinuclidin-3-yl]-2-sulfanyl-thieno[3,2-d]pyrimidin-4-one 3-[(3S)-quinuclidin-3-yl]-2-sulf…
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) | 1.91 | 6.31 | -40.52 | 1 | 4 | 0 | 45 | 293.417 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.45 | 7.32 | -36.24 | 2 | 4 | 1 | 42 | 294.425 | 1 | ↓ |