In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 20 | Yes |
Popular Name: N,N-dimethyl-3-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]propane-1-sulfonamide N,N-dimethyl-3-[(2R)-2-(pyrazol-…
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) | 0.48 | 5.06 | -43.58 | 1 | 6 | 1 | 60 | 301.436 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 2.88 | -12.46 | 0 | 6 | 0 | 58 | 300.428 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.