In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 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) | 5.68 | 13.91 | -48.96 | 0 | 6 | -1 | 62 | 465.505 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.96 | 14.06 | -17.34 | 1 | 6 | 0 | 64 | 466.513 | 8 | ↓ |