In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 37 | 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) | 5.05 | 15.02 | -49.69 | 2 | 6 | 1 | 63 | 504.695 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.24 | 12.47 | -47.55 | 1 | 6 | 0 | 69 | 503.687 | 9 | ↓ |