| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 18 | Yes |
Popular Name: N-[(1R)-1-(2,5-dimethyl-3-furyl)ethyl]-5-oxo-1,2-dihydro-1,2,4-triazole-3-carboxamide N-[(1R)-1-(2,5-dimethyl-3-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) | -0.32 | 1.07 | -9.22 | 3 | 7 | 0 | 104 | 250.258 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.14 | -1.47 | -47.67 | 2 | 7 | -1 | 107 | 249.25 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.14 | -0.38 | -22.98 | 3 | 7 | 0 | 108 | 250.258 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
