| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 22nd, 2008 | 16 | Yes |
Popular Name: : 3-(3-Imidazol-1-yl-propylamino)-[1,2,4]triazin-5-ol : 3-(3-Imidazol-1-yl-propylamino…
| 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) | -1.14 | 2.78 | -30.72 | 2 | 7 | 0 | 88 | 220.236 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.68 | 2.66 | -44.3 | 1 | 7 | -1 | 92 | 219.228 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.14 | 3.26 | -62.05 | 3 | 7 | 1 | 90 | 221.244 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.68 | 3.19 | -59.11 | 2 | 7 | 0 | 93 | 220.236 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
