In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2006 | 25 | 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) | 5.06 | 10.8 | -8.14 | 1 | 3 | 0 | 32 | 338.495 | 3 | ↓ |
Lo Low (pH 4.5-6) | 5.06 | 11.45 | -33.98 | 2 | 3 | 1 | 34 | 339.503 | 3 | ↓ |