Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LB2J5Z
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| Ligand Name |
8-(1~{H}-benzimidazol-2-ylmethyl)-3-cyclopropyl-7-(phenylmethyl)purine-2,6-dione
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| Synonyms |
8-(1~{H}-benzimidazol-2-ylmethyl)-3-cyclopropyl-7-(phenylmethyl)purine-2,6-dione; SCHEMBL18036509; IVW
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| Structure |
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Download2D MOL |
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| Formula |
C23H20N6O2
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| Canonical SMILES |
C1CC1N2C3=C(C(=O)NC2=O)N(C(=N3)CC4=NC5=CC=CC=C5N4)CC6=CC=CC=C6
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| InChI |
1S/C23H20N6O2/c30-22-20-21(29(15-10-11-15)23(31)27-22)26-19(28(20)13-14-6-2-1-3-7-14)12-18-24-16-8-4-5-9-17(16)25-18/h1-9,15H,10-13H2,(H,24,25)(H,27,30,31)
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| InChIKey |
GLUWCNQLKSIYKQ-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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