In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 34 | Yes |
Popular Name: [4-[5-ethyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]-(1-naphthyl)methanone [4-[5-ethyl-6-methyl-2-(m-tolyl)…
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) | 5.67 | 15.83 | -13.2 | 0 | 5 | 0 | 49 | 450.586 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.67 | 16.15 | -35.53 | 1 | 5 | 1 | 51 | 451.594 | 4 | ↓ |