In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 17 | 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) | 2.97 | 8.01 | -11.15 | 1 | 2 | 0 | 29 | 233.286 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.04 | 6.09 | -5.52 | 1 | 2 | 0 | 33 | 233.286 | 4 | ↓ |