| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 28th, 2011 | 16 | Yes |
Popular Name: [1-[(2-fluorophenyl)methyl]-5-methyl-triazol-4-yl]methanamine [1-[(2-fluorophenyl)methyl]-5-me…
| 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) | 1.21 | 3.24 | -52.61 | 3 | 4 | 1 | 58 | 221.259 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.21 | 2.83 | -12.62 | 2 | 4 | 0 | 57 | 220.251 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
