In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 18 | 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) | 2.33 | 6.47 | -17.21 | 1 | 4 | 0 | 70 | 277.374 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 5.36 | -48.11 | 0 | 4 | -1 | 73 | 276.366 | 3 | ↓ |