In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 17 | No |
Popular Name: 1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-methylpiperazine 1-[(3,5-dimethyl-1H-pyrazol-4-yl…
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) | 0.40 | -2.04 | -7.57 | 0 | 6 | 0 | 65 | 258.347 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.40 | 0.32 | -49.21 | 1 | 6 | 1 | 67 | 259.355 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.