In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 35 | 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) | 5.18 | 12.62 | -69.35 | 1 | 6 | 0 | 74 | 513.421 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.18 | 11.87 | -48.14 | 2 | 6 | 1 | 71 | 514.429 | 8 | ↓ |