Bioactive Compound Details

BioIDbio197559
NameNone
ChEMBL IDCHEMBL2180638
Molecular FormulaC20H25NO
Molecular Weight295.43
Molecular Weight (Monoisotopic)295.1936
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms3-[2-[(Cyclopropylmethyl)(Phenethyl)Amino]Ethyl]Phenol
SmilesOc1cccc(CCN(CCc2ccccc2)CC2CC2)c1
InchiInChI=1S/C20H25NO/c22-20-8-4-7-18(15-20)12-14-21(16-19-9-10-19)13-11-17-5-2-1-3-6-17/h1-8,15,19,22H,9-14,16H2
Inchi KeyQURAQIGQNZYJHP-UHFFFAOYSA-N
Molecular SpeciesBASE
Targets8.0
Bioactivities23.0
Np Likeness Score-0.35
Records Key['3', '68; HS666', '2; HS666']
Records Name['3-[2-[(Cyclopropylmethyl)(phenethyl)amino]ethyl]phenol', '3-[2-[cyclopropylmethyl(2-phenylethyl)amino]ethyl]phenol', '3-(2-((cyclopropylmethyl)(phenethyl)amino)ethyl)phenol']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure