Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L92WKP
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| Ligand Name |
methyl [(5E,8S)-8-[(4S)-4-(3-chlorophenyl)-2-oxopiperidin-1-yl]-2-oxo-1,3,4,7,8,10-hexahydro-2H-12,9-(azeno)-1,10-benzodiazacyclotetradecin-15-yl]carbamate
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| Synonyms |
CHEMBL4438562; methyl [(5E,8S)-8-[(4S)-4-(3-chlorophenyl)-2-oxopiperidin-1-yl]-2-oxo-1,3,4,7,8,10-hexahydro-2H-12,9-(azeno)-1,10-benzodiazacyclotetradecin-15-yl]carbamate; BDBM50525763; NR7
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| Structure |
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Download2D MOL |
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| Formula |
C29H30ClN5O4
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| Canonical SMILES |
COC(=O)NC1=CC2=C(C=C1)C3=CN=C(N3)C(CC=CCCC(=O)N2)N4CCC(CC4=O)C5=CC(=CC=C5)Cl
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| InChI |
1S/C29H30ClN5O4/c1-39-29(38)32-21-10-11-22-23(16-21)33-26(36)9-4-2-3-8-25(28-31-17-24(22)34-28)35-13-12-19(15-27(35)37)18-6-5-7-20(30)14-18/h2-3,5-7,10-11,14,16-17,19,25H,4,8-9,12-13,15H2,1H3,(H,31,34)(H,32,38)(H,33,36)/b3-2+/t19-,25-/m0/s1
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| InChIKey |
YMEHWISYYMKMFO-WOMRJYOTSA-N
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| PubChem Compound ID | ||||
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