| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 21 | No |
Popular Name: 2-[(3S)-5-[(E)-2-(4-fluorophenyl)vinyl]-3H-1,2,4-triazol-3-yl]phenol 2-[(3S)-5-[(E)-2-(4-fluorophenyl…
| 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) | 3.99 | 4.98 | -38.18 | 2 | 4 | 1 | 59 | 282.298 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | 5.71 | -115.81 | 3 | 4 | 2 | 61 | 283.306 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
