In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 10th, 2008 | 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) | 2.76 | -1.5 | -12.43 | 1 | 7 | 0 | 83 | 466.607 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.76 | -1.38 | -47.85 | 2 | 7 | 1 | 84 | 467.615 | 6 | ↓ |