In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 34 | 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) | 6.63 | 18.13 | -35.8 | 1 | 2 | 1 | 8 | 449.662 | 11 | ↓ |
Hi High (pH 8-9.5) | 6.63 | 16.59 | -3.21 | 0 | 2 | 0 | 6 | 448.654 | 11 | ↓ |