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Chemical structure of DBM-MMAF

GC65359

DBM-MMAF

Also known as (2S)-2-[[(2R,3R)-3-[(2S)-1-[(3R,4S,5S)-4-[[(2S)-2-[[(2S)-2-[6-(3,4-dibromo-2,5-dioxopyrrol-1-yl)hexanoyl-methylamino]-3-methylbutanoyl]amino]-3-methylbutanoyl]-methylamino]-3-methoxy-5-methylheptanoyl]pyrrolidin-2-yl]-3-methoxy-2-methylpropanoyl]amino]-3-phenylpropanoic acid

DBM-MMAF is a drug-linker conjugate composed of a potent antitubulin agent MMAF and a linker DBM to make antibody drug conjugate (ADC)

ChemicalCAS1810001-93-4MW1082.95FormulaC49H74Br2N6O11
CAS number
1810001-93-4
Molecular weight
1082.95
Formula
C49H74Br2N6O11
InChIKey
GZSVYZUXQREYGL-ZHOZFWKKSA-N
Catalogue number
GC65359
Brand
GLPBIO
Computed properties PubChem CID 130364162 · XLogP 6.4 · TPSA 212 Ų · H-bond donors 3
XLogP
6.4
TPSA
212 Ų
H-bond donors
3
H-bond acceptors
11
Rotatable bonds
27
Heavy atoms
68

SMILES CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)O)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)CCCCCN3C(=O)C(=C(C3=O)Br)Br

Computed descriptors from PubChem (CID 130364162), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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