In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 30th, 2008 | 35 | 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) | 4.48 | 11.31 | -51.13 | 2 | 7 | 1 | 70 | 494.685 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.48 | 11.58 | -81.78 | 3 | 7 | 2 | 71 | 495.693 | 3 | ↓ |