In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 36 | Yes |
Popular Name: [4-[6-(N,3-dimethylanilino)pyrimidin-4-yl]piperazin-1-yl]-(2-ethoxy-1-naphthyl)methanone [4-[6-(N,3-dimethylanilino)pyrim…
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) | 4.80 | 15.78 | -39.27 | 1 | 7 | 1 | 63 | 482.608 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.80 | 16.15 | -16.88 | 0 | 7 | 0 | 62 | 481.6 | 6 | ↓ |