Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LJT8F4
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| Ligand Name |
(2S)-[(3R)-1-(7-fluoro-9H-pyrimido[4,5-b]indol-4-yl)piperidin-3-yl](hydroxy)acetic acid
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| Synonyms |
(2S)-[(3R)-1-(7-fluoro-9H-pyrimido[4,5-b]indol-4-yl)piperidin-3-yl](hydroxy)acetic acid
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| Structure |
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Download2D MOL |
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| Formula |
C17H17FN4O3
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| Canonical SMILES |
C1CC(CN(C1)C2=NC=NC3=C2C4=C(N3)C=C(C=C4)F)C(C(=O)O)O
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| InChI |
1S/C17H17FN4O3/c18-10-3-4-11-12(6-10)21-15-13(11)16(20-8-19-15)22-5-1-2-9(7-22)14(23)17(24)25/h3-4,6,8-9,14,23H,1-2,5,7H2,(H,24,25)(H,19,20,21)/t9-,14+/m1/s1
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| InChIKey |
ILIKJSAPLUUPEN-OTYXRUKQSA-N
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| PubChem Compound ID | ||||
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