Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L49YJD
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| Ligand Name |
3-{1-[(3r)-1-Acryloylpiperidin-3-Yl]-4-Amino-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl}-N-(3-Tert-Butylphenyl)benzamide
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| Synonyms |
3-{1-[(3r)-1-Acryloylpiperidin-3-Yl]-4-Amino-1h-Pyrazolo[3,4-D]pyrimidin-3-Yl}-N-(3-Tert-Butylphenyl)benzamide; 4hct; Q27451789
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| Structure |
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Download2D MOL |
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| Formula |
C30H33N7O2
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| Canonical SMILES |
CC(C)(C)C1=CC(=CC=C1)NC(=O)C2=CC=CC(=C2)C3=NN(C4=NC=NC(=C34)N)C5CCCN(C5)C(=O)C=C
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| InChI |
1S/C30H33N7O2/c1-5-24(38)36-14-8-13-23(17-36)37-28-25(27(31)32-18-33-28)26(35-37)19-9-6-10-20(15-19)29(39)34-22-12-7-11-21(16-22)30(2,3)4/h5-7,9-12,15-16,18,23H,1,8,13-14,17H2,2-4H3,(H,34,39)(H2,31,32,33)/t23-/m1/s1
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| InChIKey |
RMAUIYTVKFMOGP-HSZRJFAPSA-N
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| PubChem Compound ID | ||||
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