In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 18 | 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) | 0.23 | 5.86 | -50.98 | 0 | 5 | -1 | 73 | 249.29 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 6.29 | -68.91 | 1 | 5 | 0 | 75 | 250.298 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.23 | 4.74 | -12.17 | 1 | 5 | 0 | 71 | 250.298 | 6 | ↓ |