In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2008 | 36 | 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) | 4.76 | 9.97 | -49.47 | 0 | 7 | -1 | 93 | 487.507 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.31 | 12.62 | -15.31 | 1 | 7 | 0 | 90 | 488.515 | 8 | ↓ |