In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 34 | Yes |
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) | 4.92 | 11.95 | -16.5 | 0 | 6 | 0 | 73 | 455.441 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.92 | 14.79 | -54.75 | 1 | 6 | 1 | 74 | 456.449 | 3 | ↓ |