In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 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) | 1.65 | 5.2 | -38.87 | 2 | 2 | 1 | 26 | 198.261 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.65 | 3.78 | -3.96 | 1 | 2 | 0 | 21 | 197.253 | 6 | ↓ |