In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2008 | 37 | 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) | 2.41 | 7.71 | -50.28 | 5 | 8 | 1 | 115 | 509.671 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.41 | 7.44 | -13.25 | 4 | 8 | 0 | 114 | 508.663 | 11 | ↓ |