| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 22 | Yes |
Popular Name: 1-(3-isobutoxypropyl)-3-[5-(3-thienyl)-1,3,4-thiadiazol-2-yl]urea 1-(3-isobutoxypropyl)-3-[5-(3-th…
| 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) | 3.05 | 5.54 | -16.24 | 2 | 6 | 0 | 76 | 340.474 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.67 | 3.75 | -47.92 | 1 | 6 | -1 | 82 | 339.466 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
