In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 16 | 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) | 0.77 | 3.64 | -90.83 | 5 | 4 | 2 | 61 | 231.384 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.77 | 3.34 | -39.1 | 4 | 4 | 1 | 60 | 230.376 | 9 | ↓ |