Bioactive Compound Details

BioIDbio197733
NameNone
ChEMBL IDCHEMBL2064169
Molecular FormulaC12H13NO3
Molecular Weight219.24
Molecular Weight (Monoisotopic)219.0895
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms(R,S)-2-Oxocyclobutylcarbamic Acid Benzyl Ester
SmilesO=C(NC1CCC1=O)OCc1ccccc1
InchiInChI=1S/C12H13NO3/c14-11-7-6-10(11)13-12(15)16-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,13,15)
Inchi KeyJQPGQKRCEQTGHP-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities2.0
Np Likeness Score-0.22
Records Key['15', 'BDBM50389012']
Records Name['(R,S)-2-Oxocyclobutylcarbamic Acid Benzyl Ester', 'CHEMBL2064169::US9321743, URB786']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure