In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | No |
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) | 5.74 | 10.01 | -7.61 | 2 | 4 | 0 | 62 | 419.475 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.74 | 10.32 | -43.33 | 3 | 4 | 1 | 64 | 420.483 | 4 | ↓ |