In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 29 | Yes |
Popular Name: [(2R)-2,3-dihydro-1,4-benzodioxin-2-yl]-[4-(8-quinolylmethyl)piperazin-1-yl]methanone [(2R)-2,3-dihydro-1,4-benzodioxi…
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) | 2.06 | 8.87 | -13.92 | 0 | 6 | 0 | 55 | 389.455 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.06 | 11.13 | -48.76 | 1 | 6 | 1 | 56 | 390.463 | 3 | ↓ |