| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 18 | No |
Popular Name: 5-(2-furyl)-4-methyl-2-[[methyl(propyl)amino]methyl]-1,2,4-triazole-3-thione 5-(2-furyl)-4-methyl-2-[[methyl(…
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| 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) | 1.67 | 9.84 | -36.99 | 1 | 5 | 1 | 40 | 267.378 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 7.38 | -10.76 | 0 | 5 | 0 | 39 | 266.37 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
