Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L85IUA
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| Ligand Name |
(2~{S})-5-carbamimidamido-2-[[(2~{S})-2-[[(2~{S})-1-[5-(dimethylamino)naphthalen-1-yl]sulfonylpiperidin-2-yl]carbonylamino]-4-phenyl-butanoyl]amino]pentanoic acid
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| Synonyms |
CHEMBL4636775; (2~{S})-5-carbamimidamido-2-[[(2~{S})-2-[[(2~{S})-1-[5-(dimethylamino)naphthalen-1-yl]sulfonylpiperidin-2-yl]carbonylamino]-4-phenyl-butanoyl]amino]pentanoic acid; BDBM50543421; K0T
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| Structure |
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Download2D MOL
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| Formula |
C34H45N7O6S
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| Canonical SMILES |
CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N3CCCCC3C(=O)NC(CCC4=CC=CC=C4)C(=O)NC(CCCN=C(N)N)C(=O)O
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| InChI |
1S/C34H45N7O6S/c1-40(2)28-17-8-14-25-24(28)13-9-18-30(25)48(46,47)41-22-7-6-16-29(41)32(43)38-26(20-19-23-11-4-3-5-12-23)31(42)39-27(33(44)45)15-10-21-37-34(35)36/h3-5,8-9,11-14,17-18,26-27,29H,6-7,10,15-16,19-22H2,1-2H3,(H,38,43)(H,39,42)(H,44,45)(H4,35,36,37)/t26-,27-,29-/m0/s1
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| InChIKey |
MKNCAFDCRIGOAN-YCVJPRETSA-N
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| PubChem Compound ID | ||||
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