In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 28th, 2010 | 31 | Yes |
Popular Name: [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-(methylBLAHyl)methanone [4-[(2-fluorophenyl)methyl]piper…
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) | 2.53 | 10.09 | -17.83 | 0 | 6 | 0 | 54 | 421.52 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 12.31 | -48.9 | 1 | 6 | 1 | 55 | 422.528 | 3 | ↓ |