In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2006 | 19 | Yes |
Popular Name: 8-benzo[1,3]dioxol-5-yl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-amine 8-benzo[1,3]dioxol-5-yl-1,7-diaz…
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) | 2.47 | 6.2 | -13.75 | 2 | 5 | 0 | 62 | 253.261 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 6.64 | -30.77 | 3 | 5 | 1 | 63 | 254.269 | 1 | ↓ |