In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 28th, 2008 | 19 | Yes |
None
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) | 4.41 | 11.74 | -30.98 | 1 | 1 | 1 | 4 | 252.381 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.41 | 10.05 | -1.97 | 0 | 1 | 0 | 3 | 251.373 | 2 | ↓ |