In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 20 | Yes |
Popular Name: N-[1-[(4-chloropyrazol-1-yl)methyl]-4-piperidyl]propane-1-sulfonamide N-[1-[(4-chloropyrazol-1-yl)meth…
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) | 1.44 | 1.99 | -13.98 | 1 | 6 | 0 | 67 | 320.846 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.44 | 4.28 | -53.9 | 2 | 6 | 1 | 68 | 321.854 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.