In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2010 | 23 | Yes |
Popular Name: [4-(2-dimethylaminoethyl)-2,3-dihydroquinoxalin-1-yl]-(4-pyridyl)methanone [4-(2-dimethylaminoethyl)-2,3-di…
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) | 1.73 | 8.39 | -52.05 | 1 | 5 | 1 | 41 | 311.409 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 5.92 | -11.03 | 0 | 5 | 0 | 40 | 310.401 | 4 | ↓ |