Structure of PDB 6skt Chain A Binding Site BS03 |
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| Ligand ID | E6B |
| InChI | InChI=1S/C12H14N4O3S/c13-20(18,19)11-3-1-9(2-4-11)12(17)15-6-5-10-7-14-8-16-10/h1-4,7-8H,5-6H2,(H,14,16)(H,15,17)(H2,13,18,19) |
| InChIKey | ZXCVQCNIEYRZRX-UHFFFAOYSA-N |
| SMILES | | Software | SMILES |
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| CACTVS 3.385 | N[S](=O)(=O)c1ccc(cc1)C(=O)NCCc2c[nH]cn2 | | OpenEye OEToolkits 2.0.6 | c1cc(ccc1C(=O)NCCc2c[nH]cn2)S(=O)(=O)N |
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| Formula | C12 H14 N4 O3 S |
| Name | ~{N}-[2-(1~{H}-imidazol-4-yl)ethyl]-4-sulfamoyl-benzamide |
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| DrugBank | |
| ZINC |
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| PDB chain | 6skt Chain A Residue 1004
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