In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 35 | 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) | 3.28 | 11.82 | -47.06 | 1 | 7 | 1 | 70 | 479.597 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.28 | 9.42 | -13.22 | 0 | 7 | 0 | 68 | 478.589 | 5 | ↓ |