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ML-099

CAT: 1410-M27659-01Size: 2 mgDry Ice: NoHazardous: No
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CAT#:1410-M27659-01Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
ML-099 is a pan Ras-related GTPases activator that activates Rac1, Ras, GTP-binding protein (Rab7), Rab2A and cell division cycle 42.
CAS Number
496775-95-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
259.32
Molecular Formula
C14H13NO2S
Notes
Research use only, not for human use.
Receptor
SHP-2

Chemical Information

2-[(2-Phenylethyl)thio]nicotinic acid

2-(2-phenylethylthio)-3-pyridinecarboxylic acid is a member of pyridines and an aromatic carboxylic acid.

CAS Number496775-95-2
PubChem CID888706
IUPAC Name2-(2-phenylethylsulfanyl)pyridine-3-carboxylic acid
Molecular FormulaC14H13NO2S
Molecular Weight259.33
XLogP3.2
Topological Polar Surface Area75.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity267
SMILES
C1=CC=C(C=C1)CCSC2=C(C=CC=N2)C(=O)O
InChI
InChI=1S/C14H13NO2S/c16-14(17)12-7-4-9-15-13(12)18-10-8-11-5-2-1-3-6-11/h1-7,9H,8,10H2,(H,16,17)
InChIKey
UZERZZRWECLIKE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-[(2-Phenylethyl)thio]nicotinic acid
CAS: 496775-95-2
CID: 888706
Formula: C14H13NO2S
MW: 259.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight259.33
XLogP33.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass259.06669983
Monoisotopic Mass259.06669983
Topological Polar Surface Area75.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity267
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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