In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 37 | Yes |
Popular Name: N-(1,3-benzodioxol-5-yl)-2-[4-(2-phenylquinoline-4-carbonyl)piperazin-1-yl]acetamide N-(1,3-benzodioxol-5-yl)-2-[4-(2…
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) | 3.98 | 8.93 | -21.26 | 1 | 8 | 0 | 84 | 494.551 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.98 | 11.07 | -62.86 | 2 | 8 | 1 | 85 | 495.559 | 5 | ↓ |