Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LD8K0M
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| Ligand Name |
5-[[5-chloranyl-2-[(2~{S},6~{R})-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl]amino]-1-methyl-3-(3-methyl-3-oxidanyl-butyl)benzimidazol-2-one
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| Synonyms |
CHEMBL4476234; 5-[[5-chloranyl-2-[(2~{S},6~{R})-2,6-dimethylmorpholin-4-yl]pyrimidin-4-yl]amino]-1-methyl-3-(3-methyl-3-oxidanyl-butyl)benzimidazol-2-one; SCHEMBL20568532; BDBM50511624; NQW
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| Structure |
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Download2D MOL |
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| Formula |
C23H31ClN6O3
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| Canonical SMILES |
CC1CN(CC(O1)C)C2=NC=C(C(=N2)NC3=CC4=C(C=C3)N(C(=O)N4CCC(C)(C)O)C)Cl
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| InChI |
1S/C23H31ClN6O3/c1-14-12-29(13-15(2)33-14)21-25-11-17(24)20(27-21)26-16-6-7-18-19(10-16)30(22(31)28(18)5)9-8-23(3,4)32/h6-7,10-11,14-15,32H,8-9,12-13H2,1-5H3,(H,25,26,27)/t14-,15+
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| InChIKey |
JPAZTMKUVSFPAZ-GASCZTMLSA-N
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| PubChem Compound ID | ||||
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