In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 16 | 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) | 2.02 | 4.35 | -29.84 | 4 | 4 | 1 | 61 | 224.328 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 3.98 | -7.61 | 3 | 4 | 0 | 60 | 223.32 | 8 | ↓ |