In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2008 | 30 | No |
Popular Name: 3-[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-piperidyl]-2-isopropyl-imidazo[5,4-b]pyridine 3-[1-(2,1,3-benzothiadiazol-4-yl…
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) | 3.12 | -7.11 | -17.3 | 0 | 8 | 0 | 94 | 442.57 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.12 | -6.94 | -38.93 | 1 | 8 | 1 | 95 | 443.578 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | -6.85 | -39.73 | 1 | 8 | 1 | 95 | 443.578 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.12 | -6.68 | -101.35 | 2 | 8 | 2 | 96 | 444.586 | 4 | ↓ |