Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LFU0T8
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| Ligand Name |
{4-[(2S,4E)-2-(1,3-Benzothiazol-2-YL)-2-(1H-1,2,3-benzotriazol-1-YL)-5-phenylpent-4-enyl]phenyl}(difluoro)methylphosphonic acid
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| Synonyms |
{4-[(2S,4E)-2-(1,3-BENZOTHIAZOL-2-YL)-2-(1H-1,2,3-BENZOTRIAZOL-1-YL)-5-PHENYLPENT-4-ENYL]PHENYL}(DIFLUORO)METHYLPHOSPHONIC ACID; 1q6n; P90; DB04285
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| Structure |
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Download2D MOL |
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| Formula |
C31H25F2N4O3PS
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| Canonical SMILES |
C1=CC=C(C=C1)C=CCC(CC2=CC=C(C=C2)C(F)(F)P(=O)(O)O)(C3=NC4=CC=CC=C4S3)N5C6=CC=CC=C6N=N5
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| InChI |
1S/C31H25F2N4O3PS/c32-31(33,41(38,39)40)24-18-16-23(17-19-24)21-30(20-8-11-22-9-2-1-3-10-22,29-34-26-13-5-7-15-28(26)42-29)37-27-14-6-4-12-25(27)35-36-37/h1-19H,20-21H2,(H2,38,39,40)/b11-8+/t30-/m1/s1
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| InChIKey |
GBLDYRVJENYQNH-AGLOJYHOSA-N
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| PubChem Compound ID | ||||
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