In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 22 | 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) | 3.98 | 10.24 | -28.73 | 2 | 2 | 1 | 16 | 295.45 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.98 | 10.05 | -39.18 | 2 | 2 | 1 | 20 | 295.45 | 3 | ↓ |