In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 17th, 2007 | 27 | Yes |
Popular Name: 9-amino-N-(2-benzoylphenyl)-7-thia-5-azabicyclo[4.3.0]nona-2,4,8,10-tetraene-8-carboxamide 9-amino-N-(2-benzoylphenyl)-7-th…
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) | 3.95 | -2.48 | -13.17 | 3 | 5 | 0 | 85 | 373.437 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.95 | -2.4 | -42.51 | 4 | 5 | 1 | 86 | 374.445 | 4 | ↓ |