In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2010 | 36 | No |
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) | 6.15 | 10.21 | -47.05 | 0 | 7 | -1 | 93 | 568.831 | 6 | ↓ |
Lo Low (pH 4.5-6) | 5.69 | 12.86 | -12.02 | 1 | 7 | 0 | 90 | 569.839 | 6 | ↓ |