| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 19 | No |
Popular Name: 5-(2H-benzimidazol-2-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione 5-(2H-benzimidazol-2-ylmethylene…
| 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) | 0.95 | -0.36 | -88.29 | 3 | 6 | 1 | 97 | 273.297 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.49 | 1.46 | -111.48 | 4 | 6 | 2 | 94 | 274.305 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.95 | -0.49 | -97.79 | 3 | 6 | 1 | 97 | 273.297 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
