In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 22nd, 2011 | 35 | Yes |
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) | 3.00 | 8.27 | -58.46 | 4 | 8 | 1 | 101 | 478.617 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.00 | 7.9 | -16.77 | 3 | 8 | 0 | 99 | 477.609 | 6 | ↓ |