In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 34 | 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) | 5.26 | 12.02 | -11.33 | 1 | 6 | 0 | 71 | 494.016 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 13.05 | -41.24 | 2 | 6 | 1 | 70 | 495.024 | 8 | ↓ |