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Chemical structure of SMARCA-BD ligand 1 for PROTAC hydrochloride

GC74133

SMARCA-BD ligand 1 for PROTAC hydrochloride

Also known as 2-(6-amino-5-piperazin-1-ylpyridazin-3-yl)phenol;hydrochloride

SMARCA-BD ligand 1 drochloride for PROTAC is a compound that binds to the BAF ATPase subunits SMARCA2, and used for degrading SMARCA2, based on PROTAC

ChemicalCAS2380272-56-8MW307.78FormulaC14H18ClN5O
CAS number
2380272-56-8
Molecular weight
307.78
Formula
C14H18ClN5O
Solubility
DMSO ： 10 mg/mL (32·49 mM; ultrasonic and warming and heat to 60°C)
InChIKey
RBEAPVAFLFWAKZ-UHFFFAOYSA-N
Catalogue number
GC74133
Brand
GLPBIO
Computed properties PubChem CID 156113172 · TPSA 87.3 Ų · H-bond donors 4 · H-bond acceptors 6
TPSA
87.3 Ų
H-bond donors
4
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
21

SMILES C1CN(CCN1)C2=CC(=NN=C2N)C3=CC=CC=C3O.Cl

Computed descriptors from PubChem (CID 156113172), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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