In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2006 | 19 | No |
Popular Name: 4-chloro-7-(4-nitrophenyl)-6,9-diazabicyclo[4.3.0]nona-2,4,7,9-tetraene 4-chloro-7-(4-nitrophenyl)-6,9-d…
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) | 3.56 | 9.04 | -11.99 | 0 | 5 | 0 | 63 | 273.679 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.56 | 9.47 | -50.12 | 1 | 5 | 1 | 64 | 274.687 | 2 | ↓ |