Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L4OAH0
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| Ligand Name |
N-[(1S)-4-[(2-fluoro-1-iminoethyl)amino]-1-(4-methoxy-1-methyl-1H-benzimidazol-2-yl)butyl]-2,3-dihydro-3-oxo-1H-isoindole-4-carboxamide
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| Synonyms |
2095107-57-4; PAD2-IN-2; N-[(1S)-4-[(2-fluoro-1-iminoethyl)amino]-1-(4-methoxy-1-methyl-1H-benzimidazol-2-yl)butyl]-2,3-dihydro-3-oxo-1H-isoindole-4-carboxamide; CHEMBL4214962; N-[(1S)-4-[(1-amino-2-fluoroethylidene)amino]-1-(4-methoxy-1-methylbenzimidazol-2-yl)butyl]-3-oxo-1,2-dihydroisoindole-4-carboxamide; SCHEMBL20232587; BDBM50450899; HY-125099; CS-0089317
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| Structure |
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Download2D MOL |
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| Formula |
C24H27FN6O3
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| Canonical SMILES |
CN1C2=C(C(=CC=C2)OC)N=C1C(CCCN=C(CF)N)NC(=O)C3=CC=CC4=C3C(=O)NC4
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| InChI |
1S/C24H27FN6O3/c1-31-17-9-4-10-18(34-2)21(17)30-22(31)16(8-5-11-27-19(26)12-25)29-23(32)15-7-3-6-14-13-28-24(33)20(14)15/h3-4,6-7,9-10,16H,5,8,11-13H2,1-2H3,(H2,26,27)(H,28,33)(H,29,32)/t16-/m0/s1
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| InChIKey |
DMTSALXYYYZIBF-INIZCTEOSA-N
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| PubChem Compound ID | ||||
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