In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 11th, 2009 | 19 | No |
None
None
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) | 0.49 | 3.24 | -47.01 | 1 | 5 | -1 | 82 | 275.309 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.49 | 3.95 | -42.49 | 1 | 5 | -1 | 82 | 275.309 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.49 | 3.42 | -21.41 | 2 | 5 | 0 | 83 | 276.317 | 4 | ↓ |