| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 19 | No |
Popular Name: 4-[(1S)-3-(dimethylamino)-1-methyl-propyl]-5-(2-pyridyl)-1,2,4-triazole-3-thiol 4-[(1S)-3-(dimethylamino)-1-meth…
| 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) | 1.81 | 8.8 | -55.75 | 1 | 5 | 0 | 48 | 277.397 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.08 | 9.03 | -37.58 | 2 | 5 | 1 | 51 | 278.405 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
