Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L17LQI
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| Ligand Name |
5-fluoro-N-[5-(4-methylpiperazin-1-yl)pyridin-2-yl]-4-[(4S)-4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl]pyrimidin-2-amine
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| Synonyms |
CHEMBL4578267; 5-fluoro-N-[5-(4-methylpiperazin-1-yl)pyridin-2-yl]-4-[(4S)-4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl]pyrimidin-2-amine; BDBM50521924; N14
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| Structure |
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Download2D MOL |
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| Formula |
C23H29FN8
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| Canonical SMILES |
CC1CCCCN2C1=C(C=N2)C3=NC(=NC=C3F)NC4=NC=C(C=C4)N5CCN(CC5)C
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| InChI |
1S/C23H29FN8/c1-16-5-3-4-8-32-22(16)18(14-27-32)21-19(24)15-26-23(29-21)28-20-7-6-17(13-25-20)31-11-9-30(2)10-12-31/h6-7,13-16H,3-5,8-12H2,1-2H3,(H,25,26,28,29)/t16-/m0/s1
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| InChIKey |
UHCMUGYUWQCODZ-INIZCTEOSA-N
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| PubChem Compound ID | ||||
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