In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2005 | 26 | 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) | 6.90 | 1.27 | -8.38 | 1 | 2 | 0 | 28 | 338.454 | 4 | ↓ |
Mid Mid (pH 6-8) | 6.90 | 1.47 | -26.29 | 2 | 2 | 1 | 29 | 339.462 | 4 | ↓ |