Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L84BTV
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| Ligand Name |
N-{2-[5-(4-{(1r)-1-[(4,6-Diaminopyrimidin-2-Yl)sulfanyl]ethyl}-5-Methyl-1,3-Thiazol-2-Yl)-2-Methoxyphenoxy]ethyl}methanesulfonamide
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| Synonyms |
CHEMBL3358097; DI-82; N-{2-[5-(4-{(1r)-1-[(4,6-Diaminopyrimidin-2-Yl)sulfanyl]ethyl}-5-Methyl-1,3-Thiazol-2-Yl)-2-Methoxyphenoxy]ethyl}methanesulfonamide; 4q1f; SCHEMBL17981089; BDBM50031337; HY-136499; CS-0129867; Q27453385; 2XN; N-[2-[2-Methoxy-5-[4-[(R)-1-[(4,6-diamino-2-pyrimidinyl)thio]ethyl]-5-methyl-2-thiazolyl]phenoxy]ethyl]methanesulfonamide
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| Structure |
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Download2D MOL |
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| Formula |
C20H26N6O4S3
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| Canonical SMILES |
CC1=C(N=C(S1)C2=CC(=C(C=C2)OC)OCCNS(=O)(=O)C)C(C)SC3=NC(=CC(=N3)N)N
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| InChI |
1S/C20H26N6O4S3/c1-11-18(12(2)32-20-24-16(21)10-17(22)25-20)26-19(31-11)13-5-6-14(29-3)15(9-13)30-8-7-23-33(4,27)28/h5-6,9-10,12,23H,7-8H2,1-4H3,(H4,21,22,24,25)/t12-/m1/s1
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| InChIKey |
MBPWFMBRNJJXFY-GFCCVEGCSA-N
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| PubChem Compound ID | ||||
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