In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2010 | 22 | Yes |
Popular Name: (5-chloro-2-hydroxy-phenyl)-[4-(2-pyridyl)piperazin-1-yl]methanone (5-chloro-2-hydroxy-phenyl)-[4-(…
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) | 2.74 | 6.62 | -38.38 | 2 | 5 | 1 | 58 | 318.784 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 6.67 | -49.37 | 0 | 5 | -1 | 59 | 316.768 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.74 | 6.32 | -10.5 | 1 | 5 | 0 | 57 | 317.776 | 2 | ↓ |