In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 20 | Yes |
Popular Name: 1-[(5-bromo-3-pyridyl)sulfonyl]-4-[(1S)-1-methylpropyl]piperazine 1-[(5-bromo-3-pyridyl)sulfonyl]-…
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) | 2.23 | 4.86 | -42.88 | 1 | 5 | 1 | 55 | 363.301 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 3.01 | -6.63 | 0 | 5 | 0 | 54 | 362.293 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.