| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 20 | Yes |
Popular Name: 1-isopentyl-1-methyl-3-[5-(3-thienyl)-1,3,4-thiadiazol-2-yl]urea 1-isopentyl-1-methyl-3-[5-(3-thi…
| 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) | 3.57 | 7.66 | -16.93 | 1 | 5 | 0 | 58 | 310.448 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 6.12 | -50.87 | 0 | 5 | -1 | 64 | 309.44 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
