| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2011 | 23 | No |
Popular Name: 2-[[(1E)-1-[(3R)-3-methoxycarbonyl-4,4-dimethyl-2,6-dioxo-cyclohexylidene]butyl]amino]acetic 2-[[(1E)-1-[(3R)-3-methoxycarbon…
| 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) | 0.30 | 6.99 | -47.17 | 1 | 7 | -1 | 113 | 324.353 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.84 | 5.52 | -124.03 | 0 | 7 | -2 | 119 | 323.345 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.25 | 7.49 | -31.56 | 0 | 7 | 0 | 113 | 324.353 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.