In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 34 | 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) | 3.36 | 9.08 | -11.19 | 0 | 8 | 0 | 76 | 456.55 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.36 | 11.42 | -53.31 | 1 | 8 | 1 | 77 | 457.558 | 6 | ↓ |