In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 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) | 5.32 | 13.54 | -69.36 | 1 | 6 | 0 | 74 | 507.03 | 10 | ↓ |
Lo Low (pH 4.5-6) | 5.32 | 12.77 | -45.29 | 2 | 6 | 1 | 71 | 508.038 | 10 | ↓ |