In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 21 | Yes |
Popular Name: 1-[1-(2-dimethylaminoethyl)pyrazol-4-yl]-3-(4-fluorophenyl)urea 1-[1-(2-dimethylaminoethyl)pyraz…
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) | 1.71 | 5.74 | -48.93 | 3 | 6 | 1 | 63 | 292.338 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.71 | 3.26 | -13.18 | 2 | 6 | 0 | 62 | 291.33 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.