In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 15 | 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) | -0.59 | 0.46 | -48.12 | 4 | 5 | 1 | 80 | 214.289 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.59 | -0.98 | -14.19 | 3 | 5 | 0 | 75 | 213.281 | 4 | ↓ |