In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 14th, 2010 | 19 | 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) | -0.48 | 9.85 | -114.62 | 0 | 4 | -2 | 80 | 262.305 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.48 | 5.87 | -10.09 | 2 | 4 | 0 | 75 | 264.321 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.48 | 7.84 | -52.09 | 1 | 4 | -1 | 77 | 263.313 | 6 | ↓ |