31281 <common-name>1-Aminocyclopropanecarboxylic acid</common-name> <description nil="true"/> <cas>22059-21-8</cas> <pubchem-id>535</pubchem-id> <chemical-formula>C4H7NO2</chemical-formula> <weight>101.1</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">2016-05-26T01:42:25Z</created-at> <updated-at type="dateTime">2026-08-22T18:37:15Z</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>DB02085</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(CC1)C(O)=O</moldb-smiles> <moldb-formula>C4H7NO2</moldb-formula> <moldb-inchi>InChI=1S/C4H7NO2/c5-4(1-2-4)3(6)7/h1-2,5H2,(H,6,7)</moldb-inchi> <moldb-inchikey>PAJPWUMXBYXFCZ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">101.1039</moldb-average-mass> <moldb-mono-mass type="decimal">101.047678473</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-2.7</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>520</chemspider-id> <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>CHEM030176</chemdb-id> <dsstox-id>DTXSID9039577</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00027038</susdat-id> <iupac>1-aminocyclopropane-1-carboxylic acid</iupac> <moldb-polar-surface-area>63.32</moldb-polar-surface-area> <moldb-refractivity>23.2544</moldb-refractivity> <moldb-polarizability>9.602440017818388</moldb-polarizability> <moldb-rotatable-bond-count>1</moldb-rotatable-bond-count> <moldb-acceptor-count>3</moldb-acceptor-count> <moldb-donor-count>2</moldb-donor-count> <moldb-pka-strongest-acidic>2.200941517399801</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>9.353636601438382</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>1</moldb-number-of-rings> <moldb-alogps-logp>-3.05</moldb-alogps-logp> <moldb-alogps-logs>0.64</moldb-alogps-logs> <moldb-alogps-solubility>4.37e+02 g/l</moldb-alogps-solubility> <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">6898</paper-count> <sync-id>CED0003778</sync-id> <structure-inchikey>PAJPWUMXBYXFCZ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000000008000000000000000000000000000000000000000000000000004000000000000000000000000000000000000000000000000000000000000000020000010000000000000000000000000000000010000200000000000000000000000020000000000000000000000000000000008000000000000000000000000201000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000000000000400000000000000000000000000004000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`������� ������`�������`�������(�������h��������(�������������������� ��(����B������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:10:30Z</structure-indexed-at> </compound>