In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 14 | 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) | 0.14 | 5.23 | -38.56 | 2 | 5 | 0 | 83 | 203.238 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.14 | 4.05 | -43.86 | 1 | 5 | -1 | 78 | 202.23 | 8 | ↓ |