Bioactive Compound Details

BioIDbio198265
Name2-METHOXY-5 (6)EPOXY-TETRAHYDROCARYOPHYLLENE
ChEMBL IDCHEMBL1488390
Molecular FormulaC16H28O2
Molecular Weight252.4
Molecular Weight (Monoisotopic)252.2089
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesCOC1(C)CCC2OC2(C)CCC2C1CC2(C)C
InchiInChI=1S/C16H28O2/c1-14(2)10-12-11(14)6-8-16(4)13(18-16)7-9-15(12,3)17-5/h11-13H,6-10H2,1-5H3
Inchi KeyYJNLRCNFLREHBK-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities7.0
Np Likeness Score3.05
Records Key['SID26749598', '2-METHOXY-5 (6)EPOXY-TETRAHYDROCARYOPHYLLENE', 'COVC-0677553397']
Records Name['SID26749598', '2-METHOXY-5 (6)EPOXY-TETRAHYDROCARYOPHYLLENE', '2-METHOXY-5 (6)EPOXY-TETRAHYDROCARYOPHYLLENE']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure