In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2006 | 19 | 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 | 5.5 | -11.55 | 0 | 4 | 0 | 50 | 276.361 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.74 | 5.96 | -38.72 | 1 | 4 | 1 | 52 | 277.369 | 5 | ↓ |