In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 11th, 2008 | 16 | 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) | 2.33 | 5.44 | -10.82 | 0 | 3 | 0 | 50 | 205.22 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 5.7 | -37.76 | 1 | 3 | 1 | 51 | 206.228 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 5.73 | -44.25 | 1 | 3 | 1 | 51 | 206.228 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 5.98 | -94.72 | 2 | 3 | 2 | 52 | 207.236 | 0 | ↓ |