| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2004 | 16 | No |
Popular Name: 3-Amino-5-[1-(4-chloro-phenyl)-meth-(z)-ylidene]-2-thioxo-thiazolidin-4-one 3-Amino-5-[1-(4-chloro-phenyl)-m…
Find On: PubMed — Wikipedia — Google
CAS Number: 17521-20-9
| 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) | 1.96 | -4.19 | -8.87 | 2 | 3 | 0 | 48 | 270.766 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ARY2-1-E | Arylamine N-acetyltransferase 2 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5700 | 0.46 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ARY2_MOUSE | P50295 | Arylamine N-acetyltransferase 2, Mouse | 5700 | 0.46 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Acetylation |
