In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2011 | 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) | 2.54 | 7.66 | -32.3 | 1 | 2 | 1 | 8 | 233.379 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.54 | 9.92 | -99.11 | 2 | 2 | 2 | 9 | 234.387 | 4 | ↓ |