Bioactive Compound Details

BioIDbio199681
NameNone
ChEMBL IDCHEMBL351368
Molecular FormulaC21H41NO4
Molecular Weight371.56
Molecular Weight (Monoisotopic)371.3036
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-(Tert-Butoxycarbonyl)Hexadecanoic Acid
SmilesCCCCCCCCCCCCCCC(NC(=O)OC(C)(C)C)C(=O)O
InchiInChI=1S/C21H41NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19(23)24)22-20(25)26-21(2,3)4/h18H,5-17H2,1-4H3,(H,22,25)(H,23,24)
Inchi KeyIUWRBNUWOCNQKM-UHFFFAOYSA-N
Molecular SpeciesACID
Targets6.0
Bioactivities18.0
Np Likeness Score0.03
Records Key['1', '1']
Records Name['2-tert-Butoxycarbonylamino-hexadecanoic acid', '2-(tert-butoxycarbonyl)hexadecanoic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure