In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 19 | 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) | 3.25 | 10.15 | -42.46 | 2 | 1 | 1 | 17 | 270.421 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.25 | 9.24 | -4.88 | 1 | 1 | 0 | 12 | 269.413 | 3 | ↓ |