| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 22 | Yes |
Popular Name: 1-(3-cyanophenyl)-3-[1-(2-dimethylaminoethyl)pyrazol-4-yl]urea 1-(3-cyanophenyl)-3-[1-(2-dimeth…
| 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) | 1.28 | 6.06 | -52.69 | 3 | 7 | 1 | 87 | 299.358 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.28 | 3.59 | -18.42 | 2 | 7 | 0 | 86 | 298.35 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
