| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 13 | Yes |
Popular Name: 2-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-N,N-dimethyl-ethanamine 2-(3-cyclopropyl-1H-1,2,4-triazo…
| 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) | 0.16 | 5.59 | -35.69 | 2 | 4 | 1 | 46 | 181.263 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.16 | 3.13 | -6.14 | 1 | 4 | 0 | 45 | 180.255 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
