141969 <common-name>Atumelnant</common-name> <description>Atumelnant belongs to the piperazines, a subclass of diazinanes within the organic compounds. It is classified as an organoheterocyclic compound with the chemical formula C33H42F3N5O3. With an average molecular weight of 613.73 g/mol, Atumelnant is a heavy molecule.</description> <cas>2392970-97-5</cas> <pubchem-id nil="true"/> <chemical-formula>C33H42F3N5O3</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">2026-04-15T18:24:03Z</created-at> <updated-at type="dateTime">2026-05-14T20:52:43Z</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>DB23608</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>CCOC1=CC=CC=C1C1=NC(C(=O)N[C@@H]2CN3CCC2CC3)=C(C=C1)N1CCN(C[C@H]1CC)C(=O)C1(CCC1)C(F)(F)F</moldb-smiles> <moldb-formula>C33H42F3N5O3</moldb-formula> <moldb-inchi>InChI=1S/C33H42F3N5O3/c1-3-23-20-40(31(43)32(14-7-15-32)33(34,35)36)18-19-41(23)27-11-10-25(24-8-5-6-9-28(24)44-4-2)37-29(27)30(42)38-26-21-39-16-12-22(26)13-17-39/h5-6,8-11,22-23,26H,3-4,7,12-21H2,1-2H3,(H,38,42)/t23-,26-/m0/s1</moldb-inchi> <moldb-inchikey>QJRFBKYETDVAJQ-ZEQKJWHPSA-N</moldb-inchikey> <moldb-average-mass type="decimal">613.726</moldb-average-mass> <moldb-mono-mass type="decimal">613.323974721</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM137862</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 nil="true"/> <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">20</paper-count> <sync-id>CED0029959</sync-id> <structure-inchikey>QJRFBKYETDVAJQ-ZEQKJWHPSA-N</structure-inchikey> <structure-fingerprint>800008000000020010000000000000003000000000004002000000008020000000000000080000020100000000040000000000010022000400000100000020000004010000001000000200800000801000000004010000000000000400100000088000000000000000000000201000000000048800000001048000000480000008000000000000000802000000001000000000200004000000001000000040000000000000800001020000000000e0000408000000000000000008008040004000000000000000000000000000020000000000200000000000002000000008001000040000000041400800000000020000000804008080000</structure-fingerprint> 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