In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2009 | 12 | 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) | 0.36 | 4.17 | -13.02 | 0 | 4 | 0 | 68 | 165.196 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.21 | 4.26 | -35.31 | 0 | 4 | -1 | 74 | 164.188 | 3 | ↓ |