| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 21 | Yes |
Popular Name: 4-[[(2R)-2-(5-isopropylisoxazol-3-yl)pyrrolidin-1-yl]methyl]phenol 4-[[(2R)-2-(5-isopropylisoxazol-…
| 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) | 3.25 | 7.97 | -35.05 | 2 | 4 | 1 | 51 | 287.383 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 8.76 | -54.87 | 1 | 4 | 0 | 54 | 286.375 | 4 | ↓ |
