In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 23 | Yes |
Popular Name: 4-[(S)-hydroxy-[(2R,4R,5R)-5-vinylquinuclidin-2-yl]methyl]quinolin-6-ol 4-[(S)-hydroxy-[(2R,4R,5R)-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) | 2.53 | 4.79 | -44.19 | 3 | 4 | 1 | 58 | 311.405 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.53 | 5.21 | -91.46 | 4 | 4 | 2 | 59 | 312.413 | 3 | ↓ |