In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 3rd, 2008 | 23 | 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) | 1.74 | 4.56 | -13.58 | 1 | 6 | 0 | 75 | 335.429 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.74 | 6.82 | -58.87 | 2 | 6 | 1 | 76 | 336.437 | 3 | ↓ |