In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 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) | 5.94 | 13.78 | -104.32 | 3 | 5 | 2 | 65 | 488.031 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.94 | 11.8 | -34.86 | 2 | 5 | 1 | 63 | 487.023 | 5 | ↓ |