In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2007 | 32 | Yes |
Popular Name: 4-azepan-1-ylsulfonyl-N-[5-(2-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]-benzamide 4-azepan-1-ylsulfonyl-N-[5-(2-me…
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) | 3.93 | 5.86 | -21.92 | 1 | 8 | 0 | 105 | 472.592 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.00 | 3.76 | -58 | 0 | 8 | -1 | 112 | 471.584 | 6 | ↓ |