In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 22 | 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) | 3.44 | 9.82 | -12.29 | 3 | 5 | 0 | 69 | 376.283 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.45 | 10.33 | -33.64 | 4 | 5 | 1 | 70 | 377.291 | 2 | ↓ |