In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 16 | 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) | 3.69 | 7.31 | -1.32 | 2 | 2 | 0 | 29 | 238.762 | 1 | ↓ |
Lo Low (pH 4.5-6) | 3.69 | 7.33 | -29.97 | 3 | 2 | 1 | 30 | 239.77 | 1 | ↓ |