Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LE5VJ7
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| Ligand Name |
6-cyclopropyl-N-{2-[2-(methylamino)-2-oxoethyl]phenyl}-3-[(pyrimidin-5-yl)amino]pyridine-2-carboxamide
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| Synonyms |
6-cyclopropyl-N-{2-[2-(methylamino)-2-oxoethyl]phenyl}-3-[(pyrimidin-5-yl)amino]pyridine-2-carboxamide; KG3; BDBM564495; Roche-Dataset for PDE10A, Compound 809
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| Structure |
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Download2D MOL |
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| Formula |
C22H22N6O2
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| Canonical SMILES |
CNC(=O)CC1=CC=CC=C1NC(=O)C2=C(C=CC(=N2)C3CC3)NC4=CN=CN=C4
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| InChI |
1S/C22H22N6O2/c1-23-20(29)10-15-4-2-3-5-17(15)28-22(30)21-19(26-16-11-24-13-25-12-16)9-8-18(27-21)14-6-7-14/h2-5,8-9,11-14,26H,6-7,10H2,1H3,(H,23,29)(H,28,30)
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| InChIKey |
XROCQBJCTPEKNL-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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