In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 20 | 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) | 3.39 | 5.69 | -44.09 | 2 | 3 | 1 | 29 | 340.285 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 7.18 | -37.11 | 2 | 3 | 1 | 26 | 340.285 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 8.21 | -113.25 | 3 | 3 | 2 | 30 | 341.293 | 4 | ↓ |