In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2007 | 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) | 4.66 | -1.71 | -9.94 | 1 | 4 | 0 | 54 | 345.493 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.66 | -1.68 | -34.51 | 2 | 4 | 1 | 56 | 346.501 | 3 | ↓ |