In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 14 | 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) | 2.55 | 4.9 | -38.25 | 2 | 2 | 1 | 20 | 199.362 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 7.26 | -102.15 | 3 | 2 | 2 | 21 | 200.37 | 5 | ↓ |