In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2006 | 15 | 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) | 2.34 | 4.61 | -5.79 | 1 | 2 | 0 | 33 | 201.269 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.34 | 4.89 | -32.95 | 2 | 2 | 1 | 34 | 202.277 | 2 | ↓ |