In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 16 | Yes |
None
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) | 4.28 | 7.87 | -40 | 2 | 2 | 1 | 26 | 352.09 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.28 | 6.46 | -1.93 | 1 | 2 | 0 | 21 | 351.082 | 6 | ↓ |