| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 27 | Yes |
Popular Name: 1-methyl-3-phenyl-1-[4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenyl]urea 1-methyl-3-phenyl-1-[4-[2,2,2-tr…
| 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) | 4.63 | 7.05 | -12.64 | 2 | 4 | 0 | 53 | 392.299 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DCMC-1-E | Malonyl-CoA Decarboxylase, Mitochondrial (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1564 | 0.30 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DCMC_HUMAN | O95822 | Malonyl-CoA Decarboxylase, Human | 1564 | 0.30 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Peroxisomal lipid metabolism |
