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) | 3.64 | 6.69 | -26.87 | 4 | 3 | 1 | 52 | 222.356 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.64 | 6.48 | -5.93 | 3 | 3 | 0 | 51 | 221.348 | 7 | ↓ |