| PDB CCD ID: | CDX |
| Number of entries in BioLiP: | 2 |
| Chemical formula: | C11 H16 N4 O4 |
| InChI: | InChI=1S/C11H16N4O4/c1-7(15-5-10(18)13-11(19)6-15)2-14-3-8(16)12-9(17)4-14/h7H,2-6H2,1H3,(H,12,16,17)(H,13,18,19)/t7-/m1/s1 |
| InChIKey: | BMKDZUISNHGIBY-SSDOTTSWSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | CC(CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 | | CACTVS 3.341 | C[CH](CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 | CACTVS 3.341
OpenEye OEToolkits 1.5.0 | C[C@H](CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 | | ACDLabs 10.04 | O=C2NC(=O)CN(CC(N1CC(=O)NC(=O)C1)C)C2 |
|
| Name: | (S)-4,4'-(1-METHYL-1,2-ETHANEDIYL)BIS-2,6-PIPERAZINEDIONE;
ICRF-187 |
| ChEMBL: | CHEMBL1231714 |
| ZINC: | ZINC000087515510 |
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