In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 16 | Yes |
Popular Name: (4-chloro-2-hydroxy-phenyl)-piperazin-1-yl-methanone (4-chloro-2-hydroxy-phenyl)-pipe…
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) | 1.34 | 2.76 | -55.59 | 3 | 4 | 1 | 57 | 241.698 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.34 | 2.36 | -52.03 | 1 | 4 | -1 | 55 | 239.682 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 3.76 | -79.32 | 2 | 4 | 0 | 60 | 240.69 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 1.36 | -12.55 | 2 | 4 | 0 | 53 | 240.69 | 1 | ↓ |