Products for Research Use Only
RegisterLogin

GGTI-2418

CAT: 0127-BISN0072-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BISN0072-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
501010-06-6
MDL Number
MFCD25976818
Purity
98%
Smiles
CC(C)C[C@H](NC(=O)N1CCN(Cc2[nH]cnc2C)C(=O)[C@@H]1Cc3ccccc3)C(=O)O
Notes
GGTI-2418 is a highly potent, competitive, and selective GGTase I inhibitor with IC50 value of 9.5nM.

Chemical Information

Ggti-2418

Geranylgeranyltransferase I Inhibitor PTX-100 is a small molecule and synthetic peptidomimetic inhibitor of the protein geranylgeranyltransferase type 1 (GGTase-I; GGT-1), with potential antineoplastic activity. Upon administration, GGTase-I inhibitor PTX-100 targets and binds to GGTase-I, an enzyme involved in the posttranslational modification of numerous oncogenic GTPases, including K-Ras, N-Ras, RhoA, RhoC, Cdc42, RalA, RalB, Rap1 and Rac1. Inhibition of geranylgeranylation (GG), inhibits the post-translational modification of these oncogenic proteins, inhibits their membrane localization and oncogenic activity. This prevents Ras-mediated signaling and prevents Ras-mediated cancer cell proliferation, migration, invasion, and metastasis. This may result in cell cycle arrest and induce apoptosis. In addition, PTX-100 may also downregulate a variety of other activated cancer survival pathways. Protein geranylgeranylation, catalyzed by GGTase-I, plays a critical role in malignant transformation and cancer cell proliferation, migration, and invasion.

CAS Number501010-06-6
PubChem CID11539477
IUPAC Name(2S)-2-[[(2S)-2-benzyl-4-[(5-methyl-1H-imidazol-4-yl)methyl]-3-oxopiperazine-1-carbonyl]amino]-4-methylpentanoic acid
Molecular FormulaC23H31N5O4
Molecular Weight441.5
XLogP2.2
Topological Polar Surface Area119
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count32
Formal Charge0
Complexity667
SMILES
CC1=C(N=CN1)CN2CCN([C@H](C2=O)CC3=CC=CC=C3)C(=O)N[C@@H](CC(C)C)C(=O)O
InChI
InChI=1S/C23H31N5O4/c1-15(2)11-18(22(30)31)26-23(32)28-10-9-27(13-19-16(3)24-14-25-19)21(29)20(28)12-17-7-5-4-6-8-17/h4-8,14-15,18,20H,9-13H2,1-3H3,(H,24,25)(H,26,32)(H,30,31)/t18-,20-/m0/s1
InChIKey
COLCNDRDBCLVOC-ICSRJNTNSA-N
Chemical Structure
2D Structure
2D structure of Ggti-2418
CAS: 501010-06-6
CID: 11539477
Formula: C23H31N5O4
MW: 441.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight441.5
XLogP32.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass441.23760449
Monoisotopic Mass441.23760449
Topological Polar Surface Area119 Ų
Heavy Atom Count32
Formal Charge0
Complexity667
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
BUP07293-01GGTI-2133
BUP03317-01GGTI 2147
BUP00970GGTI 2147 FA

Alternative Products

CatalogName
BA2803-25GGTI-2418
A13112-500GGTI-2418 500mg
A13112-50GGTI-2418 50mg
A13112-10GGTI-2418 10mg
A13112-5GGTI-2418 5mg
A13112-100GGTI-2418 100mg
A13112-25GGTI-2418 25mg
A13112-1GGTI-2418 1mg
GTR19210478-01SIMR-2418
T70157-01GGTI-297

Popular Products