Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LGQ29D
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| Ligand Name |
N-[(1s,2r)-1-Benzyl-3-{[(1s)-2-(Cyclohexylamino)-1-Methyl-2-Oxoethyl]amino}-2-Hydroxypropyl]-3-(Pentylsulfonyl)benzamide
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| Synonyms |
CHEMBL402305; N-[(1s,2r)-1-Benzyl-3-{[(1s)-2-(Cyclohexylamino)-1-Methyl-2-Oxoethyl]amino}-2-Hydroxypropyl]-3-(Pentylsulfonyl)benzamide; BDBM50373812; Q27467037; VG3
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| Structure |
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Download2D MOL
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| Formula |
C31H45N3O5S
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| Canonical SMILES |
CCCCCS(=O)(=O)C1=CC=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CNC(C)C(=O)NC3CCCCC3)O
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| InChI |
1S/C31H45N3O5S/c1-3-4-11-19-40(38,39)27-18-12-15-25(21-27)31(37)34-28(20-24-13-7-5-8-14-24)29(35)22-32-23(2)30(36)33-26-16-9-6-10-17-26/h5,7-8,12-15,18,21,23,26,28-29,32,35H,3-4,6,9-11,16-17,19-20,22H2,1-2H3,(H,33,36)(H,34,37)/t23-,28-,29+/m0/s1
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| InChIKey |
FBMGVFBNGKNQCB-WTWMYVDVSA-N
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| PubChem Compound ID | ||||
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