In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 15 | No |
Popular Name: 3-[2-[(E)-3-hydroxy-3-oxo-prop-1-enyl]pyrrol-1-yl]propanoic 3-[2-[(E)-3-hydroxy-3-oxo-prop-1…
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) | 0.47 | 5.45 | -108.93 | 0 | 5 | -2 | 85 | 207.185 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.47 | 4.36 | -50.5 | 1 | 5 | -1 | 82 | 208.193 | 5 | ↓ |