306792 <common-name>3-(1h-imidazol-5-ylmethyl)-6-(1h-indol-3-ylmethyl)piperazine-2,5-dione</common-name> <description>3-(1h-imidazol-5-ylmethyl)-6-(1h-indol-3-ylmethyl)piperazine-2,5-dione belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. This organic acid and derivative has the formula C17H17N5O2 and an average molecular weight of 323.35 g/mol.</description> <cas nil="true"/> <pubchem-id>24066854</pubchem-id> <chemical-formula>C17H17N5O2</chemical-formula> <weight>323.35</weight> <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">2026-08-29T00:36:39Z</created-at> <updated-at type="dateTime">2026-08-29T00:36:39Z</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 nil="true"/> <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>C1=CC=C2C(=C1)C(=CN2)CC3C(=O)NC(C(=O)N3)CC4=CN=CN4</moldb-smiles> <moldb-formula>C17H17N5O2</moldb-formula> <moldb-inchi>InChI=1S/C17H17N5O2/c23-16-14(5-10-7-19-13-4-2-1-3-12(10)13)21-17(24)15(22-16)6-11-8-18-9-20-11/h1-4,7-9,14-15,19H,5-6H2,(H,18,20)(H,21,24)(H,22,23)</moldb-inchi> <moldb-inchikey>YNHVZXATNGMVNC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">323.1382248</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1</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>CHEM302685</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>3-(1h-imidazol-5-ylmethyl)-6-(1h-indol-3-ylmethyl)piperazine-2,5-dione</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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0257847</sync-id> <structure-inchikey>YNHVZXATNGMVNC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800200001100000000000000000000000000000000000000008000040020008000000008002000000000000010000020002000000000000000000000000000000000000000000020000000000000004000000000000000000000020000000000000000000008000000000000000000040000000000100020000000000000800000200000000000000000800100000000000000000000000000400000000004040000080000000000000000000000000000000000000100000000040000001100000000000000000000400000000000000200000001000000000000000000000041001000000000004200000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>501200100912864081000b40012820000190140001052004083520408a00088c54220050128000000000410804c0000004600224c08c32010226647000a04000c6110c001290048040901000026202000844059053211b3a40440c22500048020c2805270048020060000410d5140200200680700119c00431992a2802510012104000184ef08208080612408e2c0008193c081244c014830002082000c00084184310000090c00002000960057c2d104ac00200894108481880421008c04210800000a404800a3301800604145102800c010800024058200d00020408010300101048101881020400400411515a2000001000308042002e4008108052000046</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@h�������@(������@(������@h�������@(������@h�������@8��������`�������`�������(�������(�������h��������`�������(�������(�������h��������`������@(������@h�������@(������@h�������@8���������h���h���h���h���h���h���h���h�� � � ����(�� �������(��� ��������h���h���h���h���h���h�� ���h�B������������������� ��� ����������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:15:11Z</structure-indexed-at> </compound>