In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 38 | 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) | 5.89 | 15.34 | -69.04 | 1 | 6 | 0 | 74 | 533.068 | 11 | ↓ |
Hi High (pH 8-9.5) | 5.89 | 13.14 | -60.22 | 0 | 6 | -1 | 73 | 532.06 | 11 | ↓ |