In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2009 | 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) | 4.44 | 11.67 | -25.44 | 1 | 10 | 0 | 130 | 497.577 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.63 | 10.21 | -59.84 | 0 | 10 | -1 | 137 | 496.569 | 11 | ↓ |