In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2010 | 32 | No |
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) | 2.93 | 6.32 | -11.12 | 2 | 8 | 0 | 89 | 434.496 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.93 | 7.85 | -45.82 | 3 | 8 | 1 | 90 | 435.504 | 3 | ↓ |