In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 27 | Yes |
None
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) | 3.96 | 11.59 | -40.84 | 2 | 5 | 1 | 59 | 365.501 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.96 | 10.53 | -12.15 | 1 | 5 | 0 | 58 | 364.493 | 5 | ↓ |