| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2004 | 18 | No |
Popular Name: 5-(difluoromethyl)-4-[(E)-(3-fluorobenzylidene)amino]-1,2,4-triazole-3-thiolate 5-(difluoromethyl)-4-[(E)-(3-flu…
| 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) | 2.39 | 8.09 | -48.8 | 0 | 4 | -1 | 43 | 271.247 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.67 | 7.34 | -9.04 | 1 | 4 | 0 | 46 | 272.255 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
