DUBs-IN-2

CAT: 0957-E0389-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0957-E0389-02Size:25 mg

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Description

DUBs-IN-2 is a potent inhibitor of USP7 and USP8 deubiquitinating enzymes.

CAS Number

924296-19-5

Target

DUB

Activity

Ubiquitin

Molecular Formula

C15H9N5O

Storage Conditions

3 years -20°C powder

Chemical Information

DUBs-IN-2

DUB-IN-2 is an EC 3.4.19.* (omega-peptidase) inhibitor.

CAS Number	924296-19-5
PubChem CID	16065491
IUPAC Name	(9E)-9-ethoxyiminoindeno[1,2-b]pyrazine-2,3-dicarbonitrile
Molecular Formula	C15H9N5O
Molecular Weight	275.26
XLogP	2.3
Topological Polar Surface Area	95
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Heavy Atom Count	21
Formal Charge	0
Complexity	527

SMILES

CCO/N=C/1\C2=CC=CC=C2C3=NC(=C(N=C31)C#N)C#N

InChI

InChI=1S/C15H9N5O/c1-2-21-20-14-10-6-4-3-5-9(10)13-15(14)19-12(8-17)11(7-16)18-13/h3-6H,2H2,1H3/b20-14+

InChIKey

VKVAJBRQGBRHIK-XSFVSMFZSA-N

Chemical Structure

2D Structure

CAS: 924296-19-5

CID: 16065491

Formula: C15H9N5O

MW: 275.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	275.26
XLogP3	2.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Exact Mass	275.08070993
Monoisotopic Mass	275.08070993
Topological Polar Surface Area	95 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	527
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes