In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 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) | 5.37 | 12.26 | -55.28 | 0 | 5 | -1 | 70 | 460.937 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.37 | 11.52 | -11.38 | 1 | 5 | 0 | 67 | 461.945 | 8 | ↓ |