In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 19th, 2006 | 15 | 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) | -0.68 | 2.34 | -47.88 | 1 | 5 | -1 | 82 | 207.209 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.68 | 2.62 | -69.97 | 2 | 5 | 0 | 83 | 208.217 | 5 | ↓ |