In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2010 | 38 | 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) | 0.60 | 6.33 | -67.63 | 4 | 10 | 1 | 120 | 529.706 | 7 | ↓ |
Lo Low (pH 4.5-6) | 0.60 | 6.68 | -109.44 | 5 | 10 | 2 | 122 | 530.714 | 7 | ↓ |