In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2007 | 22 | 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) | 2.86 | -2.76 | -11.3 | 1 | 4 | 0 | 54 | 311.41 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.86 | -2.72 | -33.77 | 2 | 4 | 1 | 56 | 312.418 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.86 | -2.7 | -38.16 | 2 | 4 | 1 | 56 | 312.418 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.86 | -2.66 | -75.97 | 3 | 4 | 2 | 57 | 313.426 | 3 | ↓ |