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ML-099

CAT: 0957-E4700-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0957-E4700-02Size:25 mg
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Description
ML099 (CID-888706) is a pan-activator of Ras-related GTPases. It enhances GTPase activity by increasing its affinity for guanine nucleotides through binding to an allosteric site between switch regions I and II.
CAS Number
496775-95-2
Synonyms
CID-888706
Target
Ras
Activity
Apoptosis
Molecular Formula
C14H13NO2S

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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Alternative Products

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HY-124306-01ML-099
A24225-100ML-099 (CID-888706) 100mg
A24225-5ML-099 (CID-888706) 5mg
A24225-50ML-099 (CID-888706) 50mg
A24225-10ML-099 (CID-888706) 10mg
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