<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">362566</id>
  <title nil="true"/>
  <common-name>4,5,6,7-tetrahydro-2h-pyrazolo[3,4-b]pyridine-3-carboxylic acid</common-name>
  <description>4,5,6,7-tetrahydro-2h-pyrazolo[3,4-b]pyridine-3-carboxylic acid is a chemical compound with the formula C7H9N3O2. It has an average molecular weight of 167.17 g/mol.</description>
  <cas>1369161-41-0</cas>
  <pubchem-id>136305483</pubchem-id>
  <chemical-formula>C7H9N3O2</chemical-formula>
  <weight>167.17</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">2026-09-01T11:52:09Z</created-at>
  <updated-at type="dateTime">2026-09-01T11:52:09Z</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>C1CC2=C(NN=C2NC1)C(=O)O</moldb-smiles>
  <moldb-formula>C7H9N3O2</moldb-formula>
  <moldb-inchi>InChI=1S/C7H9N3O2/c11-7(12)5-4-2-1-3-8-6(4)10-9-5/h1-3H2,(H,11,12)(H2,8,9,10)</moldb-inchi>
  <moldb-inchikey>HROYYDWPBIVSOU-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">167.0694765</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.8</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>CHEM358459</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>4,5,6,7-tetrahydro-2h-pyrazolo[3,4-b]pyridine-3-carboxylic 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>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>CED0312627</sync-id>
  <structure-inchikey>HROYYDWPBIVSOU-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000000000000000000000000001000000000000000000000000000004000000000000040002004000000000000000080000000000000000000000000000000000000000000000020000000000000000000000000800000000002010000000000000000000002001000020000000000000000000000000800400000000000000000200000000000000000000000000000000000000000200002000000000000000000080100000000000000000000040000000000000000000000000000000000000000000000000000080000000000200000000000000000000000000000002000000000000400000000000000000000080000000080</structure-fingerprint>
  <structure-pattern-fingerprint>10002100902060400000000010820080000040000040000002420404210080c50000070008200000080010800880000042000a0018c30410002443002a000008411040002100800009010a001620100000001905201013260000420000089080c22440400400220240800005030020022068030018de0041318282000110002024400084c4000100800020088080008112c0012444034a2400408008000001400430080000040000a010841012c203002c920008043884018804200084002500040000404400a1301800000044102800500000002484020041002040800010000100800020110060000000200022000001000100040000a000280005a000422</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ�����������������������€���`�������`������@(������@(������@8�������@(������@(�������h��������`�������(�������(�������h���������������h���h���h���h��� ����	 	
(�	� �����h�B���������������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:59:33Z</structure-indexed-at>
</compound>
