In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: 2-[4-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]sulfonylpyrazol-1-yl]acetic 2-[4-[(3R)-3-(dimethylamino)pyrr…
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) | -0.98 | 3.41 | -78.37 | 1 | 8 | 0 | 100 | 302.356 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.98 | 1 | -51.01 | 0 | 8 | -1 | 99 | 301.348 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.