In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 23 | Yes |
Popular Name: 4-[[1-(2-dimethylaminoethyl)pyrazol-4-yl]carbamoylamino]benzamide 4-[[1-(2-dimethylaminoethyl)pyra…
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) | 0.37 | 2.46 | -56.29 | 5 | 8 | 1 | 106 | 317.373 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.37 | -0.01 | -21.15 | 4 | 8 | 0 | 105 | 316.365 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.