In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 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) | -0.18 | 1.73 | -90.28 | 5 | 4 | 2 | 61 | 201.314 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.18 | 1.33 | -37.88 | 4 | 4 | 1 | 60 | 200.306 | 3 | ↓ |