In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (1S,2S)-2-[[1-(2-diethylaminoethyl)pyrazol-4-yl]carbamoyl]cyclopropanecarboxylic (1S,2S)-2-[[1-(2-diethylaminoeth…
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) | 0.62 | 6.85 | -76.63 | 2 | 7 | 0 | 91 | 294.355 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.62 | 4.7 | -51.33 | 1 | 7 | -1 | 90 | 293.347 | 8 | ↓ |
Lo Low (pH 4.5-6) | 0.62 | 4.87 | -46.66 | 3 | 7 | 1 | 89 | 295.363 | 8 | ↓ |