In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 38 | No |
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) | 2.45 | 6.44 | -61.02 | 1 | 10 | -1 | 127 | 528.578 | 14 | ↓ |
Lo Low (pH 4.5-6) | 2.45 | 5.69 | -17.61 | 2 | 10 | 0 | 124 | 529.586 | 14 | ↓ |