In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 9 | 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) | 0.15 | 3.64 | -39.74 | 1 | 2 | 1 | 22 | 126.179 | 0 | ↓ |
Hi High (pH 8-9.5) | 0.15 | 0.96 | -5.19 | 0 | 2 | 0 | 20 | 125.171 | 0 | ↓ |