Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LD38IF
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| Ligand Name |
N-[(1S)-4-(1-aminoethylideneamino)-1-(1H-benzimidazol-2-yl)butyl]-3-oxoisoindole-4-carboxamide
|
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| Structure |
 |
Download2D MOL |
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| Formula |
C22H22N6O2
|
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| Canonical SMILES |
CC(=NCCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC=CC4=C3C(=O)N=C4)N
|
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| InChI |
1S/C22H22N6O2/c1-13(23)24-11-5-10-18(20-26-16-8-2-3-9-17(16)27-20)28-21(29)15-7-4-6-14-12-25-22(30)19(14)15/h2-4,6-9,12,18H,5,10-11H2,1H3,(H2,23,24)(H,26,27)(H,28,29)/t18-/m0/s1
|
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| InChIKey |
YBTBNNSKYRVVMF-SFHVURJKSA-N
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| PubChem Compound ID | ||||
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