In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 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) | 4.74 | 12.96 | -18.02 | 1 | 5 | 0 | 62 | 487.962 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.74 | 13.43 | -49.53 | 2 | 5 | 1 | 64 | 488.97 | 8 | ↓ |