| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 21 | Yes |
Popular Name: 2,2-dimethyl-7-[(2S)-3,3,3-trifluoro-2-hydroxy-propoxy]chroman-4-one 2,2-dimethyl-7-[(2S)-3,3,3-trifl…
| 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) | 2.72 | 3.84 | -8.41 | 1 | 4 | 0 | 56 | 304.264 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 4.38 | -43.65 | 0 | 4 | -1 | 59 | 303.256 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
