In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 35 | No |
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) | 0.33 | 5.18 | -75.46 | 1 | 10 | 0 | 124 | 500.577 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.33 | 2.64 | -63.63 | 0 | 10 | -1 | 123 | 499.569 | 8 | ↓ |