Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LGH4Z2
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| Ligand Name |
6-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-2-(prop-2-en-1-yl)-1-{6-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]pyridin-2-yl}-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
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| Synonyms |
6-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-2-(prop-2-en-1-yl)-1-{6-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]pyridin-2-yl}-1,2-dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one; RAC-IV-016; 99J
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| Structure |
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Download2D MOL |
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| Formula |
C26H27F3N8O2
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| Canonical SMILES |
CN1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C(=N3)N(N(C4=O)CC=C)C5=CC=CC(=N5)C(C(F)(F)F)O
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| InChI |
1S/C26H27F3N8O2/c1-3-11-36-24(39)19-16-30-25(31-17-7-9-18(10-8-17)35-14-12-34(2)13-15-35)33-23(19)37(36)21-6-4-5-20(32-21)22(38)26(27,28)29/h3-10,16,22,38H,1,11-15H2,2H3,(H,30,31,33)/t22-/m0/s1
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| InChIKey |
DQUHCAHRQQRKGR-QFIPXVFZSA-N
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| PubChem Compound ID | ||||
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