In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2009 | 33 | 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) | 4.93 | 10.52 | -48.41 | 1 | 6 | -1 | 94 | 455.515 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.93 | 9.39 | -23.09 | 2 | 6 | 0 | 91 | 456.523 | 4 | ↓ |