In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 32 | Yes |
Popular Name: N-[4-[5-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-1,3,4-oxadiazol-2-yl]phenyl]benzenesulfonamide N-[4-[5-[[2-(azepan-1-yl)-2-keto…
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) | 4.06 | -6.61 | -15.14 | 1 | 8 | 0 | 105 | 472.592 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.06 | -6.03 | -43.67 | 0 | 8 | -1 | 107 | 471.584 | 7 | ↓ |