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Homer

CAT: 0013-GTR19239537-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239537-02Size:5 mg
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Description
Homer is a potent and selective WDR5 degrader with a DC50 of 53 nM in MV4-11 cells, acting post-translationally without affecting WDR5 mRNA. This probe is a valuable chemical tool for investigating WDR5 function in chromatin regulation and leukemia models, both in vitro and in vivo.
CAS Number
2737222-94-3
Field of Research
Cell Biology, Molecular Biology, Neuroscience, Pharmacology & Drug Discovery
Purity
99.93% (May vary between batches)
Smiles
N (C (=O) C=1C (C (F) (F) F) =CC (=O) NC1) C2=C (C=CC (=C2) C3=CC=C (C (NCCCCC (N[C@H] (C (=O) N4[C@H] (C (NCC5=CC=C (C=C5) C=6SC=NC6C) =O) C[C@@H] (O) C4) C (C) (C) C) =O) =O) C=C3) N7CCN (C) CC7
Molecular Formula
C52H60F3N9O7S
Molecular Weight
1012.15
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Homer
CAS Number2737222-94-3
PubChem CID157049306
IUPAC NameN-[5-[4-[[5-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-5-oxopentyl]carbamoyl]phenyl]-2-(4-methylpiperazin-1-yl)phenyl]-6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carboxamide
Molecular FormulaC52H60F3N9O7S
Molecular Weight1012.1
XLogP4.8
Topological Polar Surface Area234
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count14
Rotatable Bond Count17
Heavy Atom Count72
Formal Charge0
Complexity1990
SMILES
CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)NC(=O)CCCCNC(=O)C4=CC=C(C=C4)C5=CC(=C(C=C5)N6CCN(CC6)C)NC(=O)C7=CNC(=O)C=C7C(F)(F)F)O
InChI
InChI=1S/C52H60F3N9O7S/c1-31-45(72-30-59-31)34-11-9-32(10-12-34)27-58-49(70)42-25-37(65)29-64(42)50(71)46(51(2,3)4)61-43(66)8-6-7-19-56-47(68)35-15-13-33(14-16-35)36-17-18-41(63-22-20-62(5)21-23-63)40(24-36)60-48(69)38-28-57-44(67)26-39(38)52(53,54)55/h9-18,24,26,28,30,37,42,46,65H,6-8,19-23,25,27,29H2,1-5H3,(H,56,68)(H,57,67)(H,58,70)(H,60,69)(H,61,66)/t37-,42+,46-/m1/s1
InChIKey
OFNZESNEBSQKSE-BQGOKDIQSA-N
Chemical Structure
2D Structure
2D structure of Homer
CAS: 2737222-94-3
CID: 157049306
Formula: C52H60F3N9O7S
MW: 1012.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1012.1
XLogP34.8
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count14
Rotatable Bond Count17
Exact Mass1011.42885095
Monoisotopic Mass1011.42885095
Topological Polar Surface Area234 Ų
Heavy Atom Count72
Formal Charge0
Complexity1990
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
T201354-01Homer
70R-12718Homer antibody
H6850-05BHomer 1
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MBS6481099-01Homer 3 (Homer Protein Homolog 3, HOMER3, Homer-3, VESL3) (FITC)
MBS6481097-01Homer 3 (Homer Protein Homolog 3, HOMER3, Homer-3, VESL3) (APC)
MBS6481096-01Homer 3 (Homer Protein Homolog 3, HOMER3, Homer-3, VESL3) (AP)
127996HOMER3 (Homer Protein Homolog 3, Homer-3)
247179HOMER3 (Homer Homolog 3 (Drosophila), HOMER-3)
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