In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2008 | 35 | 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) | 6.66 | 10.05 | -19.4 | 2 | 7 | 0 | 93 | 509.653 | 8 | ↓ |
Hi High (pH 8-9.5) | 7.12 | 8.8 | -51.56 | 1 | 7 | -1 | 96 | 508.645 | 8 | ↓ |