In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 14 | 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) | -0.56 | 5.17 | -29.38 | 1 | 4 | 0 | 48 | 198.266 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.56 | 2.98 | -43.68 | 0 | 4 | -1 | 47 | 197.258 | 4 | ↓ |