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Chemical structure of MM-102 TFA

GC36632

MM-102 TFA

Also known as N-[bis(4-fluorophenyl)methyl]-1-[[(2S)-5-(diaminomethylideneamino)-2-[[2-ethyl-2-(2-methylpropanoylamino)butanoyl]amino]pentanoyl]amino]cyclopentane-1-carboxamide;2,2,2-trifluoroacetic acid

MM-102 TFA (HMTase Inhibitor IX TFA) is a potent WDR5/MLL interaction inhibitor, achieves IC50 = 2·4 nM with an estimated Ki 200 times more potent than the ARA peptide

ChemicalCAS1883545-52-5MW783.83FormulaC37H50F5N7O6
CAS number
1883545-52-5
Molecular weight
783.83
Formula
C37H50F5N7O6
Solubility
DMSO: ≥ 100 mg/mL (127·58 mM)
InChIKey
ZRKTWBXVGMHWHM-YCBFMBTMSA-N
Catalogue number
GC36632
Brand
GLPBIO
Computed properties PubChem CID 71520620 · TPSA 218 Ų · H-bond donors 7 · H-bond acceptors 12
TPSA
218 Ų
H-bond donors
7
H-bond acceptors
12
Rotatable bonds
16
Heavy atoms
55

SMILES CCC(CC)(C(=O)N[C@@H](CCCN=C(N)N)C(=O)NC1(CCCC1)C(=O)NC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)NC(=O)C(C)C.C(=O)(C(F)(F)F)O

Computed descriptors from PubChem (CID 71520620), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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