In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2006 | 22 | 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) | -0.48 | 1.1 | -63.84 | 6 | 7 | 0 | 133 | 305.334 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.48 | 0.79 | -52.14 | 5 | 7 | -1 | 131 | 304.326 | 7 | ↓ |