In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2011 | 38 | 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) | 5.17 | 10.51 | -16.89 | 1 | 8 | 0 | 88 | 537.682 | 10 | ↓ |
Lo Low (pH 4.5-6) | 5.17 | 11.29 | -47.55 | 2 | 8 | 1 | 89 | 538.69 | 10 | ↓ |