Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LH8I4K
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| Ligand Name |
6-[(2~{S})-2-fluoranylpropyl]-4-[(1-methylcyclopropyl)amino]-2-[[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]amino]pyrido[4,3-d]pyrimidin-5-one
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| Synonyms |
6-[(2~{S})-2-fluoranylpropyl]-4-[(1-methylcyclopropyl)amino]-2-[[1-(1-methylpiperidin-4-yl)pyrazol-4-yl]amino]pyrido[4,3-d]pyrimidin-5-one; B4U
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| Structure |
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Download2D MOL |
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| Formula |
C23H31FN8O
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| Canonical SMILES |
CC(CN1C=CC2=C(C1=O)C(=NC(=N2)NC3=CN(N=C3)C4CCN(CC4)C)NC5(CC5)C)F
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| InChI |
1S/C23H31FN8O/c1-15(24)13-31-11-6-18-19(21(31)33)20(29-23(2)7-8-23)28-22(27-18)26-16-12-25-32(14-16)17-4-9-30(3)10-5-17/h6,11-12,14-15,17H,4-5,7-10,13H2,1-3H3,(H2,26,27,28,29)/t15-/m0/s1
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| InChIKey |
AQXBTRKLRVCCRH-HNNXBMFYSA-N
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| PubChem Compound ID | ||||
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