In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 17 | 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) | 4.14 | 6.37 | -40.45 | 3 | 2 | 1 | 37 | 269.151 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.14 | 5.99 | -3.6 | 2 | 2 | 0 | 35 | 268.143 | 3 | ↓ |