In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2005 | 19 | Yes |
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) | -2.08 | -10.75 | -48.37 | 5 | 8 | 1 | 113 | 269.281 | 2 | ↓ |
Mid Mid (pH 6-8) | -4.48 | -10.54 | -97.02 | 6 | 8 | 2 | 115 | 270.289 | 2 | ↓ |