In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 21st, 2010 | 36 | 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) | 4.27 | 11.63 | -56.74 | 0 | 8 | -1 | 104 | 514.974 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.27 | 10.88 | -17.09 | 1 | 8 | 0 | 101 | 515.982 | 4 | ↓ |