In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 33 | Yes |
Popular Name: [4-[5,6-dimethyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]-(1-naphthyl)methanone [4-[5,6-dimethyl-2-(m-tolyl)pyri…
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) | 5.21 | 15.14 | -13.66 | 0 | 5 | 0 | 49 | 436.559 | 3 | ↓ |
Mid Mid (pH 6-8) | 5.21 | 15.46 | -35.92 | 1 | 5 | 1 | 51 | 437.567 | 3 | ↓ |