In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2006 | 27 | No |
Popular Name: 9-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2,3,4,5,6,7,9,9a-octahydroacridine-1,8-dione 9-(3-chloro-5-ethoxy-4-hydroxy-p…
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) | 3.82 | 7.89 | -17.64 | 1 | 5 | 0 | 76 | 387.863 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.98 | 7.08 | -10.05 | 1 | 5 | 0 | 76 | 387.863 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.98 | 7.03 | -12.31 | 1 | 5 | 0 | 76 | 387.863 | 3 | ↓ |