| Category: | PADi |
| Description: | Cl-amidine- PADI , strongly affects the expression of several cell cycle genes implicated in tumor progression, including p21, GADD45?, and Ki67. |
| Synonyms: |
| 2D Image: |  |
| Structure 2D: | Download |
| Molecular Formula: | C14H19ClN4O2 |
| Molecular Weight: | 310.782 g/mol |
| IUPAC name: | N-[(2S)-1-amino-5-[(1-amino-2-chloroethylidene)amino]-1-oxopentan-2-yl]benzamide |
| InChI: | InChI=1S/C14H19ClN4O2/c15-9-12(16)18-8-4-7-11(13(17)20)19-14(21)10-5-2-1-3-6-10/ h1-3,5-6,11H,4,7-9H2,(H2,16,18)(H2,17,20)(H,19,21)/t11-/m0/s1 |
| SMILES: | NC(=O)[C@H](CCCNC(=N)CCl)NC(=O)c1ccccc1 |
| FDA status: | Experimental |
| FDA_UNII: | - |
| Clinical Trials : | Not recruiting Clinical Trials |
| AID | CID | SID | Assay Name | Target GI | Target GeneID | Bioactivity Outcome |
| 712850 | 24970878 | 163326132 | Toxicity in C57BL/6J mouse assessed as bloody stools at 150 mg/kg, po |
Unspecified | ||
| 712851 | 24970878 | 163326132 | Toxicity in C57BL/6J mouse assessed as heavy breathing at 150 mg/kg, po after 1 to 4 hrs |
Unspecified | ||
| 712852 | 24970878 | 163326132 | Toxicity in C57BL/6J mouse assessed as hunching at 150 mg/kg, po after 1 to 4 hrs |
Unspecified | ||
| 712858 | 24970878 | 163326132 | Drug metabolism in C57Bl/6 mouse at 10 mg/kg, ip measured within 4 hrs by LC-MS/MS analysis |
Active | ||
| 712859 | 24970878 | 163326132 | Half life in mouse liver microsomes |
Unspecified |
| Literature Reference: | PMC3572853 |
| Literature: | Pubmed Google Scholar |
| PubChem ID: | 24970878 |
| PubChem Citation: | National Center for Biotechnology Information. PubChem Compound Database; CID=24970878, https://pubchem.ncbi.nlm.nih.gov/compound/24970878 (accessed Mar. 8, 2019). |
| ChEMBL ID: | CHEMBL1962361 |
| ZINC DB: | - |
| LiverTox: | Not available for Cl-amidine |
| Human Metabolome database : | HMDB |