| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 20 | Yes |
Popular Name: 4-anilino-3-(4-methoxybenzyl)-2-methyl-4-oxobutanoic acid 4-anilino-3-(4-methoxybenzyl)-2-…
| 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) | 0.91 | 3.32 | -39.11 | 2 | 6 | 1 | 61 | 276.316 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.91 | 2.31 | -13.28 | 1 | 6 | 0 | 60 | 275.308 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.91 | 4.62 | -52.06 | 2 | 6 | 1 | 61 | 276.316 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
