| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 16 | No |
Popular Name: 2-[(4R)-1-(2-dimethylaminoethyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]acetic 2-[(4R)-1-(2-dimethylaminoethyl)…
| 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) | -0.27 | 5.91 | -65.5 | 1 | 6 | 0 | 77 | 227.264 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | 3.39 | -53.13 | 0 | 6 | -1 | 76 | 226.256 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | 3.44 | -52.94 | 0 | 6 | -1 | 76 | 226.256 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
