In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 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) | 6.72 | 16.14 | -45.79 | 1 | 5 | 1 | 51 | 501.701 | 8 | ↓ |
Hi High (pH 8-9.5) | 6.72 | 14.09 | -14.45 | 0 | 5 | 0 | 49 | 500.693 | 8 | ↓ |