| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 20 | Yes |
Popular Name: 2-[1-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]triazol-4-yl]propan-2-amine 2-[1-[(4-methoxy-3,5-dimethyl-2-…
| 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) | 1.91 | 3.19 | -99.18 | 4 | 6 | 2 | 82 | 277.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.91 | 2.49 | -12.13 | 2 | 6 | 0 | 79 | 275.356 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 2.75 | -54.46 | 3 | 6 | 1 | 80 | 276.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
