In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 21st, 2011 | 32 | Yes |
Popular Name: 1-[4-[4-[6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]phenyl]ethanone 1-[4-[4-[6-methyl-2-[4-(trifluor…
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) | 5.18 | 13.84 | -42.45 | 1 | 5 | 1 | 51 | 441.477 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.18 | 13.62 | -13.82 | 0 | 5 | 0 | 49 | 440.469 | 5 | ↓ |