In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 20 | Yes |
Popular Name: 2-[4-[(5-bromo-3-pyridyl)sulfonyl]piperazin-1-yl]acetic 2-[4-[(5-bromo-3-pyridyl)sulfony…
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) | -0.64 | 1.72 | -46.56 | 0 | 7 | -1 | 94 | 363.213 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.64 | 3.84 | -38.86 | 1 | 7 | 0 | 95 | 364.221 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.