In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 37 | 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) | 4.81 | 10.29 | -57.35 | 0 | 8 | -1 | 107 | 527.663 | 12 | ↓ |
Lo Low (pH 4.5-6) | 4.81 | 9.54 | -15.67 | 1 | 8 | 0 | 104 | 528.671 | 12 | ↓ |