In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2008 | 39 | 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) | 4.28 | 12.89 | -16.66 | 0 | 8 | 0 | 86 | 522.605 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 15.22 | -49.77 | 1 | 8 | 1 | 88 | 523.613 | 8 | ↓ |