135523 <common-name>Burixafor</common-name> <description>Burixafor is an organic compound with the chemical formula C27H51N8O3P. Burixafor belongs to the piperazines, a subclass of diazinanes within the organic compounds. With an average molecular weight of 566.73 g/mol, Burixafor is a heavy molecule. Classified as an organoheterocyclic compound, it acts as an inhibitor of C-X-C chemokine receptor type 4 (CXCR4).</description> <cas>1191448-17-5</cas> <pubchem-id nil="true"/> <chemical-formula>C27H51N8O3P</chemical-formula> <weight nil="true"/> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-04-14T18:32:11Z</created-at> <updated-at type="dateTime">2026-05-14T19:15:25Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id>DB11970</drugbank-id> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>NC1=NC(NC[C@H]2CC[C@H](CNCCCNC3CCCCC3)CC2)=NC(=C1)N1CCN(CCP(O)(O)=O)CC1</moldb-smiles> <moldb-formula>C27H51N8O3P</moldb-formula> <moldb-inchi>InChI=1S/C27H51N8O3P/c28-25-19-26(35-15-13-34(14-16-35)17-18-39(36,37)38)33-27(32-25)31-21-23-9-7-22(8-10-23)20-29-11-4-12-30-24-5-2-1-3-6-24/h19,22-24,29-30H,1-18,20-21H2,(H2,36,37,38)(H3,28,31,32,33)/t22-,23-</moldb-inchi> <moldb-inchikey>QLVSJMZJSABWRX-YHBQERECSA-N</moldb-inchikey> <moldb-average-mass type="decimal">566.732</moldb-average-mass> <moldb-mono-mass type="decimal">566.382174532</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-0.38</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM131416</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>(2-{4-[6-amino-2-({[(1r,4r)-4-({[3-(cyclohexylamino)propyl]amino}methyl)cyclohexyl]methyl}amino)pyrimidin-4-yl]piperazin-1-yl}ethyl)phosphonic acid</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organoheterocyclic compounds</superklass> <klass>Diazinanes</klass> <subklass>Piperazines</subklass> <paper-count type="integer">59</paper-count> <sync-id>CED0022298</sync-id> <structure-inchikey>QLVSJMZJSABWRX-YHBQERECSA-N</structure-inchikey> <structure-fingerprint>2000000400000002002080001000000000000000000000008000000000000000000002000000000000000000000000200000010000080000000000000200000000010000000000400000000000000000002000100000000000000000000000001000000209000000000000000010002000000002010000000000000200080018080000000000080000000000000000508000110000000000000000000000000000002000000400000000000008000000008002000000400000a000000802000000000000400200000800000420000000010000000000010000000000000010010000000000024001000040000000010000000100004000000010000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������'���*���€���h�������@(������@(������@(�������h��������`������ 4��������`�������`������ 4��������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������@(������@(������@h��������(�������`�������`������� ������`�������`������� ������`�������`�������(�������`�������`�������� ��h���h��� ������������� � � ������ � ����������������������� �������h���h���h��� ������������� � !�!"�!#�!$���%�%&���h�&��������B�������������� ��������������%&�����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:49:36Z</structure-indexed-at> </compound>