Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L12SEH
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| Ligand Name |
FXIa-IN-6
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| Synonyms |
FXIa-IN-6; CHEMBL4638245; methyl ((10R,14S)-14-(4-(3-chloro-2,6-difluorophenyl)-6-oxo-3,6-dihydro- 1(2h)-pyridinyl)-10-methyl-9-oxo-8,16-diazatricyclo[13.3.1.0~2,7~]nonadeca- 1(19),2,4,6,15,17-hexaen-5-yl)carbamate; FXIa-6f; FXIa-IN-6f; SCHEMBL15456413; GLXC-25195; BDBM50541586; HY-145349; CS-0371695; 1551459-37-0
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| Structure |
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Download2D MOL |
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| Formula |
C31H29ClF2N4O4
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| Canonical SMILES |
CC1CCCC(C2=NC=CC(=C2)C3=C(C=C(C=C3)NC(=O)OC)NC1=O)N4CCC(=CC4=O)C5=C(C=CC(=C5F)Cl)F
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| InChI |
1S/C31H29ClF2N4O4/c1-17-4-3-5-26(38-13-11-19(15-27(38)39)28-23(33)9-8-22(32)29(28)34)25-14-18(10-12-35-25)21-7-6-20(36-31(41)42-2)16-24(21)37-30(17)40/h6-10,12,14-17,26H,3-5,11,13H2,1-2H3,(H,36,41)(H,37,40)/t17-,26+/m1/s1
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| InChIKey |
AXXYATYQRMPQSN-QUGAMOGWSA-N
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| PubChem Compound ID | ||||
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