| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 17 | Yes |
Popular Name: 2-[5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]ethanamine 2-[5-[(4-methoxyphenyl)methyl]-1…
| 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) | 1.00 | 3.16 | -55.09 | 3 | 4 | 1 | 63 | 250.347 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.00 | 2.77 | -9.87 | 2 | 4 | 0 | 61 | 249.339 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
