In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 22 | Yes |
Popular Name: 1-(3,4-dichlorophenyl)-3-[1-(2-dimethylaminoethyl)pyrazol-4-yl]urea 1-(3,4-dichlorophenyl)-3-[1-(2-d…
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) | 2.83 | 6.65 | -50.05 | 3 | 6 | 1 | 63 | 343.238 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.83 | 4.18 | -15.01 | 2 | 6 | 0 | 62 | 342.23 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.