In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 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) | 1.72 | 4.82 | -32.49 | 2 | 3 | 1 | 28 | 249.378 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.72 | 2.39 | -3.67 | 1 | 3 | 0 | 27 | 248.37 | 4 | ↓ |