Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LCV95X
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| Ligand Name |
(2e)-3-[4-({4-Amino-5-Cyano-6-[(3s,5s,7s)-Tricyclo[3.3.1.1~3,7~]dec-1-Ylamino]pyridin-2-Yl}amino)-2-(Cyanomethoxy)phenyl]-N-(2-Methoxyethyl)prop-2-Enamide
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| Synonyms |
(2e)-3-[4-({4-Amino-5-Cyano-6-[(3s,5s,7s)-Tricyclo[3.3.1.1~3,7~]dec-1-Ylamino]pyridin-2-Yl}amino)-2-(Cyanomethoxy)phenyl]-N-(2-Methoxyethyl)prop-2-Enamide; SCHEMBL13514363; Q27464008
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| Structure |
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Download2D MOL |
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| Formula |
C30H35N7O3
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| Canonical SMILES |
COCCNC(=O)C=CC1=C(C=C(C=C1)NC2=NC(=C(C(=C2)N)C#N)NC34CC5CC(C3)CC(C5)C4)OCC#N
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| InChI |
1S/C30H35N7O3/c1-39-9-7-34-28(38)5-3-22-2-4-23(13-26(22)40-8-6-31)35-27-14-25(33)24(18-32)29(36-27)37-30-15-19-10-20(16-30)12-21(11-19)17-30/h2-5,13-14,19-21H,7-12,15-17H2,1H3,(H,34,38)(H4,33,35,36,37)/b5-3+
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| InChIKey |
XFGLTLTUEITKOH-HWKANZROSA-N
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| PubChem Compound ID | ||||
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