In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2006 | 24 | 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) | 4.26 | 11.82 | -47.82 | 1 | 4 | 1 | 44 | 326.416 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.26 | 9.66 | -11.55 | 0 | 4 | 0 | 43 | 325.408 | 7 | ↓ |