In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | No |
Popular Name: 2-[[(3S)-quinuclidin-3-yl]amino]-6,7-dihydro-5H-cyclopenta[b]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) | 2.17 | 7.44 | -38.04 | 4 | 4 | 1 | 55 | 303.455 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 7.74 | -96.05 | 5 | 4 | 2 | 57 | 304.463 | 3 | ↓ |