In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2006 | 25 | Yes |
Popular Name: (2-hydroxy-3-methyl-phenyl)-(4-phenylsulfonylpiperazin-1-yl)-methanone (2-hydroxy-3-methyl-phenyl)-(4-p…
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) | 2.39 | 4.32 | -13.92 | 1 | 6 | 0 | 78 | 360.435 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 5.13 | -54.65 | 0 | 6 | -1 | 81 | 359.427 | 3 | ↓ |