In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 13th, 2009 | 24 | 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) | 5.08 | 10.44 | -58.53 | 1 | 4 | -1 | 69 | 336.427 | 13 | ↓ |
Lo Low (pH 4.5-6) | 5.08 | 9.32 | -20.28 | 2 | 4 | 0 | 66 | 337.435 | 13 | ↓ |