Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BLB0U9
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| Binder Name |
(1R,2S,6R)-2-[5-[[1-(4-Chlorophenyl)cyclopropyl]methylamino]-2-fluorophenyl]-2-(difluoromethyl)-5-oxa-3-azabicyclo[4.1.0]hept-3-en-4-amine
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| Synonyms |
CHEMBL3688797; SCHEMBL16077315; BDBM171744; US9085576, 370
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL |
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| Formula |
C22H21ClF3N3O
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| Canonical SMILES |
C1CC1(CNC2=CC(=C(C=C2)F)[C@@]3([C@H]4C[C@H]4OC(=N3)N)C(F)F)C5=CC=C(C=C5)Cl
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| InChI |
1S/C22H21ClF3N3O/c23-13-3-1-12(2-4-13)21(7-8-21)11-28-14-5-6-17(24)15(9-14)22(19(25)26)16-10-18(16)30-20(27)29-22/h1-6,9,16,18-19,28H,7-8,10-11H2,(H2,27,29)/t16-,18+,22+/m0/s1
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| InChIKey |
SXNZDNAXNDWVBG-AQOAWAETSA-N
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| PubChem Compound ID | ||||
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