In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 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) | 1.56 | 4.77 | -40.63 | 4 | 4 | 1 | 60 | 264.393 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 2.69 | -11.04 | 3 | 4 | 0 | 58 | 263.385 | 6 | ↓ |