In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 28 | 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) | -0.55 | 6.72 | -110.81 | 3 | 8 | 0 | 115 | 388.399 | 5 | ↓ |
Lo Low (pH 4.5-6) | -4.13 | 5.77 | -82.89 | 4 | 8 | 1 | 118 | 389.407 | 4 | ↓ |