| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 24 | No |
Popular Name: 2-[(3S)-5-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-3H-1,2,4-triazol-3-yl]phenol 2-[(3S)-5-[(E)-2-(3,4-dimethoxyp…
| 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) | 3.48 | 4.03 | -41.14 | 2 | 6 | 1 | 77 | 324.36 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 4.97 | -121.08 | 3 | 6 | 2 | 79 | 325.368 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
