In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2006 | 28 | No |
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) | 2.81 | 5.95 | -58.59 | 1 | 6 | -1 | 90 | 400.838 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.25 | -1.64 | -19.44 | 2 | 6 | 0 | 87 | 401.846 | 6 | ↓ |