In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 37 | No |
None
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) | 5.80 | 12.85 | -14.63 | 0 | 6 | 0 | 57 | 494.591 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.80 | 15.69 | -61.44 | 1 | 6 | 1 | 58 | 495.599 | 6 | ↓ |