| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: 4-[[1-(2-diethylaminoethyl)pyrazol-4-yl]amino]-4-oxo-butanoic 4-[[1-(2-diethylaminoethyl)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) | 0.06 | 6.16 | -74.38 | 2 | 7 | 0 | 91 | 282.344 | 9 | ↓ |
| Hi High (pH 8-9.5) | 0.06 | 4.04 | -49.41 | 1 | 7 | -1 | 90 | 281.336 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 0.06 | 4.19 | -45.88 | 3 | 7 | 1 | 89 | 283.352 | 9 | ↓ |
