In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2010 | 15 | 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) | 1.36 | 3.96 | -6.22 | 4 | 5 | 0 | 76 | 209.297 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.36 | 4.34 | -27.16 | 5 | 5 | 1 | 77 | 210.305 | 6 | ↓ |