In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2007 | 25 | Yes |
Popular Name: 5-(4-bromophenyl)-4-(3-pyridylsulfonyl)-1,4-diazabicyclo[4.3.0]nona-6,8-diene 5-(4-bromophenyl)-4-(3-pyridylsu…
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) | 3.25 | 7.52 | -11.84 | 0 | 5 | 0 | 55 | 418.316 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 7.79 | -49.94 | 1 | 5 | 1 | 56 | 419.324 | 3 | ↓ |