In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2006 | 22 | Yes |
Popular Name: 1-[1-[(5-chloro-2-thienyl)sulfonyl]-4-piperidyl]azepane 1-[1-[(5-chloro-2-thienyl)sulfon…
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) | 3.83 | 7.31 | -42.93 | 1 | 4 | 1 | 42 | 363.956 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.83 | 5.56 | -6.94 | 0 | 4 | 0 | 41 | 362.948 | 3 | ↓ |