In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2009 | 29 | 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) | 5.16 | 9.07 | -39.4 | 0 | 5 | -1 | 64 | 448.973 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.70 | 10.16 | -12.04 | 1 | 5 | 0 | 61 | 449.981 | 8 | ↓ |