In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 35 | Yes |
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) | 4.99 | 13.05 | -26.3 | 2 | 7 | 0 | 87 | 491.661 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.17 | 11.34 | -63.99 | 1 | 7 | -1 | 94 | 490.653 | 6 | ↓ |