BDBM79388 (5R)-1-[[(2S)-1-[(2R)-2-[(4R)-2-azanylidene-4-[(2R)-butan-2-yl]-3-[2-(3,4-dichlorophenyl)ethyl]imidazolidin-1-yl]-3-methyl-butyl]pyrrolidin-2-yl]methyl]-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine::(5R)-1-[[(2S)-1-[(2R)-2-[(4R)-4-[(2R)-butan-2-yl]-3-[2-(3,4-dichlorophenyl)ethyl]-2-imino-1-imidazolidinyl]-3-methylbutyl]-2-pyrrolidinyl]methyl]-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine::(5R)-1-[[(2S)-1-[(2R)-2-[(4R)-4-[(2R)-butan-2-yl]-3-[2-(3,4-dichlorophenyl)ethyl]-2-iminoimidazolidin-1-yl]-3-methylbutyl]pyrrolidin-2-yl]methyl]-5-(2-methylpropyl)-4,5-dihydroimidazol-2-amine::MLS002477274::SMR001399197::[(5R)-1-[[(2S)-1-[(2R)-2-[(4R)-3-[2-(3,4-dichlorophenyl)ethyl]-2-imino-4-[(1R)-1-methylpropyl]imidazolidin-1-yl]-3-methyl-butyl]pyrrolidin-2-yl]methyl]-5-isobutyl-2-imidazolin-2-yl]amine::cid_44246579

SMILES CC[C@@H](C)[C@@H]1CN([C@@H](CN2CCC[C@H]2CN2[C@H](CC(C)C)CN=C2N)C(C)C)C(=N)N1CCc1ccc(Cl)c(Cl)c1

InChI Key InChIKey=CQCAFCHBUMFWEZ-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 79388   

TargetCorticotropin-releasing factor-binding protein(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79388(MLS002477274 | cid_44246579 | (5R)-1-[[(2S)-1-[(2R...)
Affinity DataIC50: 7.10E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2013
Entry Details
PCBioAssay
TargetUbiquitin-conjugating enzyme E2 N(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79388(MLS002477274 | cid_44246579 | (5R)-1-[[(2S)-1-[(2R...)
Affinity DataIC50: 2.00E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay
TargetCorticotropin-releasing factor-binding protein(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79388(MLS002477274 | cid_44246579 | (5R)-1-[[(2S)-1-[(2R...)
Affinity DataEC50:  4.23E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2012
Entry Details
PCBioAssay