In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 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) | 3.08 | 10.26 | -11.53 | 2 | 7 | 0 | 85 | 373.416 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.25 | 10.04 | -38.94 | 3 | 7 | 1 | 89 | 374.424 | 3 | ↓ |