In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2006 | 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) | 3.92 | 10.3 | -7.72 | 1 | 9 | 0 | 133 | 325.284 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.92 | 10.17 | -36.45 | 0 | 9 | -1 | 132 | 324.276 | 4 | ↓ |