In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 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) | 3.14 | 7.49 | -33.97 | 1 | 3 | 1 | 23 | 250.362 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.14 | 5.43 | -3.91 | 0 | 3 | 0 | 22 | 249.354 | 5 | ↓ |