In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2008 | 36 | Yes |
Popular Name: 1,3-benzodioxol-5-yl-[4-[2-(1-naphthyl)imidazo[5,4-b]pyridin-3-yl]-1-piperidyl]methanone 1,3-benzodioxol-5-yl-[4-[2-(1-na…
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) | 4.74 | -1.03 | -21.09 | 0 | 7 | 0 | 69 | 476.536 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.74 | -0.85 | -39.3 | 1 | 7 | 1 | 71 | 477.544 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.74 | -0.77 | -43.51 | 1 | 7 | 1 | 71 | 477.544 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.74 | -0.6 | -106.16 | 2 | 7 | 2 | 72 | 478.552 | 3 | ↓ |