In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 23 | Yes |
Popular Name: 4-[(S)-hydroxy-[(2R,4S,5S)-5-vinylquinuclidin-2-yl]methyl]quinolin-6-ol 4-[(S)-hydroxy-[(2R,4S,5S)-5-vin…
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) | 2.52 | 5.04 | -42.69 | 3 | 4 | 1 | 58 | 311.405 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 5.8 | -50.38 | 2 | 4 | 0 | 61 | 310.397 | 3 | ↓ |