In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 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) | 1.01 | 1.68 | -37.12 | 3 | 3 | 1 | 40 | 201.334 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 2.59 | -32.24 | 3 | 3 | 1 | 37 | 201.334 | 9 | ↓ |