In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 30th, 2008 | 27 | No |
None
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) | 3.32 | 7.7 | -50.84 | 1 | 6 | -1 | 85 | 383.497 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 7.79 | -16.61 | 2 | 6 | 0 | 83 | 384.505 | 5 | ↓ |