In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 19 | Yes |
Popular Name: [(3S)-3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinuclidin-3-yl]methanamine [(3S)-3-(6,7-dihydro-4H-thieno[3…
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) | 1.14 | 3.93 | -118.55 | 4 | 3 | 2 | 35 | 279.453 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 1.52 | -48.41 | 3 | 3 | 1 | 34 | 278.445 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 5.1 | -37.18 | 3 | 3 | 1 | 34 | 278.445 | 2 | ↓ |