In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 15 | 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) | 2.15 | 5.45 | -51.1 | 2 | 3 | 1 | 37 | 213.345 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.15 | 4.07 | -7.46 | 1 | 3 | 0 | 32 | 212.337 | 5 | ↓ |