In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 33 | 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) | 3.41 | 8.88 | -55.36 | 1 | 7 | -1 | 107 | 499.943 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.41 | 6.9 | -16.89 | 2 | 7 | 0 | 104 | 500.951 | 8 | ↓ |