In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2011 | 21 | Yes |
Popular Name: 2-[4-[(5-bromo-3-pyridyl)sulfonyl]piperazin-1-yl]-N,N-dimethyl-ethanamine 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) | 1.06 | 2.81 | -42.88 | 1 | 6 | 1 | 58 | 378.316 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.06 | 0.35 | -7.3 | 0 | 6 | 0 | 57 | 377.308 | 5 | ↓ |