In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 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) | 0.70 | 7.52 | -48.56 | 1 | 3 | 1 | 41 | 204.297 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.70 | 5.13 | -9.27 | 0 | 3 | 0 | 40 | 203.289 | 6 | ↓ |