In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2008 | 31 | Yes |
Popular Name: 2-[4-[2-phenyl-6-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]ethanol 2-[4-[2-phenyl-6-[3-(trifluorome…
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) | 4.38 | 7.88 | -12.36 | 1 | 5 | 0 | 52 | 428.458 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.38 | 8.09 | -32.03 | 2 | 5 | 1 | 54 | 429.466 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.38 | 10.45 | -90.51 | 3 | 5 | 2 | 55 | 430.474 | 6 | ↓ |