In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 24 | 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) | 4.24 | 7.68 | -11.87 | 1 | 5 | 0 | 73 | 326.348 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.24 | 8.45 | -50.69 | 0 | 5 | -1 | 76 | 325.34 | 8 | ↓ |