In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2008 | 34 | Yes |
Popular Name: (methylBLAHyl)-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methanone (methylBLAHyl)-[4-[[3-(trifluoro…
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) | 3.29 | 11.09 | -18.42 | 0 | 6 | 0 | 54 | 471.527 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.29 | 13.74 | -94.36 | 2 | 6 | 2 | 57 | 473.543 | 4 | ↓ |