In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 18 | No |
Popular Name: 2-[[(3S)-quinuclidin-3-yl]amino]pyridine-3-carbothioamide 2-[[(3S)-quinuclidin-3-yl]amino]…
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) | 1.30 | 5.55 | -43.28 | 4 | 4 | 1 | 55 | 263.39 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.30 | 5.84 | -107.03 | 5 | 4 | 2 | 57 | 264.398 | 3 | ↓ |