| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 19 | No |
Popular Name: 2-(diethylamino)-N-[5-(2-furyl)-4H-1,2,4-triazol-3-yl]acetamide 2-(diethylamino)-N-[5-(2-furyl)-…
| 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) | 1.12 | 6.28 | -43.17 | 2 | 7 | 0 | 95 | 263.301 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.12 | 3.95 | -50.88 | 1 | 7 | -1 | 93 | 262.293 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.30 | 6.84 | -41.87 | 3 | 7 | 1 | 88 | 264.309 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
