VHL Ligand 36

CAT: 0931-T207197-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T207197-01Size:10 mg

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CAS Number

2250056-48-3

Target

Ligand for E3 Ligase

Related Pathways

PROTAC

Bioactivity

VHL Ligand 36 is a ligand of the von Hippel-Lindau (VHL) protein. It is used in the synthesis of SD-2301.

Smiles

C([C@H](C(C)(C)C)O)(=O)N1[C@H](C(N[C@@H](C)C2=CC=C(C=C2)C3=C(C)N=CS3)=O)C[C@@H](O)C1

Molecular Formula

C23H31N3O4S

Molecular Weight

445.58

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

(2S,4R)-4-hydroxy-1-((S)-2-hydroxy-3,3-dimethylbutanoyl)-N-((S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethyl)pyrrolidine-2-carboxamide

CAS Number	2250056-48-3
PubChem CID	167729622
IUPAC Name	(2S,4R)-4-hydroxy-1-[(2S)-2-hydroxy-3,3-dimethylbutanoyl]-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide
Molecular Formula	C23H31N3O4S
Molecular Weight	445.6
XLogP	2.7
Topological Polar Surface Area	131
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	31
Formal Charge	0
Complexity	647

SMILES

CC1=C(SC=N1)C2=CC=C(C=C2)[C@H](C)NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)O)O

InChI

InChI=1S/C23H31N3O4S/c1-13(15-6-8-16(9-7-15)19-14(2)24-12-31-19)25-21(29)18-10-17(27)11-26(18)22(30)20(28)23(3,4)5/h6-9,12-13,17-18,20,27-28H,10-11H2,1-5H3,(H,25,29)/t13-,17+,18-,20+/m0/s1

InChIKey

UHRQKDWYKAUUPQ-UUZHKXTQSA-N

Chemical Structure

2D Structure

CAS: 2250056-48-3

CID: 167729622

Formula: C23H31N3O4S

MW: 445.6

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	445.6
XLogP3	2.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	445.20352765
Monoisotopic Mass	445.20352765
Topological Polar Surface Area	131 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	647
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T13958	VHL Ligand 8
T87617-01	VHL Ligand 14
T201850-01	E3 ligase Ligand 36
T17908-01	VHL Ligand-Linker Conjugates 15
T18873-01	VHL Ligand-Linker Conjugates 17
T210975-01	DASK1-VHL
T209567-01	VHL-SF2
T83649-01	VHL 15a
T79720-01	VHL-IN-1
T200695-01	P60-L3-VHL

Alternative Products

Catalog	Name
F4600-07-01	Flt3 Ligand (Fms-like Tyrosine Kinase 3 Ligand, flk2 Ligand)
cyt-340-01	mFlt3 Ligand
522887-01	FAS Ligand
400305-01	Flt3 ligand
MBS7042993-01	Kit ligand
AP81626	CD40 ligand
GTR19020256-01	ICOS ligand
cyt-1041-01	pFlt3 Ligand
cyt-157-01	rmFlt3 Ligand
PC52087	Walphos ligand

VHL Ligand 36

Chemical Information

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