In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 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) | 3.76 | 5.56 | -7.65 | 1 | 2 | 0 | 33 | 231.32 | 1 | ↓ |
Hi High (pH 8-9.5) | 3.76 | 6.33 | -50.9 | 0 | 2 | -1 | 36 | 230.312 | 1 | ↓ |