| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2009 | 18 | Yes |
Popular Name: 1-[4-(difluoromethoxy)phenyl]-N-(4H-1,2,4-triazol-3-ylmethyl)methanamine 1-[4-(difluoromethoxy)phenyl]-N-…
| 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) | 1.07 | 4.92 | -45.38 | 3 | 5 | 1 | 67 | 255.248 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 4.74 | -39.53 | 2 | 5 | 0 | 66 | 254.24 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.07 | 3.56 | -11.53 | 2 | 5 | 0 | 63 | 254.24 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
