| PDB CCD ID: | YVW |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C12 H13 N3 O |
| InChI: | InChI=1S/C12H13N3O/c16-12-7-13-11(6-14-12)10-5-8-3-1-2-4-9(8)15-10/h1-5,11,13,15H,6-7H2,(H,14,16)/t11-/m0/s1 |
| InChIKey: | AKZZWJXICXKZDI-NSHDSACASA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | c1ccc2c(c1)cc([nH]2)[C@@H]3CNC(=O)CN3 | | CACTVS 3.385 | O=C1CN[C@@H](CN1)c2[nH]c3ccccc3c2 | | OpenEye OEToolkits 2.0.7 | c1ccc2c(c1)cc([nH]2)C3CNC(=O)CN3 | | CACTVS 3.385 | O=C1CN[CH](CN1)c2[nH]c3ccccc3c2 |
|
| Name: | (5~{S})-5-(1~{H}-indol-2-yl)piperazin-2-one |
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