In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 2nd, 2006 | 28 | 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) | 4.63 | 11.27 | -11.15 | 1 | 5 | 0 | 48 | 393.874 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.63 | 11.71 | -34.46 | 2 | 5 | 1 | 49 | 394.882 | 6 | ↓ |