In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 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) | 6.10 | 12.69 | -50.34 | 0 | 5 | -1 | 73 | 498.342 | 4 | ↓ |
Lo Low (pH 4.5-6) | 6.10 | 11.94 | -12.49 | 1 | 5 | 0 | 71 | 499.35 | 4 | ↓ |