In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2006 | 31 | No |
Popular Name: 2-(2,4-dimethoxyphenyl)-4-(2-pyridylmethylaminomethylene)isoquinoline-1,3-dione 2-(2,4-dimethoxyphenyl)-4-(2-pyr…
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) | 2.31 | -1.43 | -14.28 | 0 | 7 | 0 | 81 | 415.449 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.31 | -0.47 | -45.4 | 1 | 7 | 1 | 82 | 416.457 | 6 | ↓ |