In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 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) | 5.12 | 7.01 | -44.28 | 1 | 6 | -1 | 91 | 413.91 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.12 | -2.81 | -18.73 | 2 | 6 | 0 | 88 | 414.918 | 7 | ↓ |