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Chemical structure of EDP-305

GC65260

EDP-305

Also known as 1-(4-tert-butylphenyl)sulfonyl-3-[(3R)-3-[(3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]butyl]urea

EDP-305 is an orally active, potent and selective farnesoid X receptor (FXR) agonist, with EC50 values of 34 nM (chimeric FXR in CHO cells) and 8 nM (full-length FXR in HEK cells)

ChemicalCAS1933507-63-1MW630.92FormulaC36H58N2O5S
CAS number
1933507-63-1
Molecular weight
630.92
Formula
C36H58N2O5S
InChIKey
SJKLCUGQVVYDCX-HRNVLBFRSA-N
Catalogue number
GC65260
Brand
GLPBIO
Computed properties PubChem CID 121428882 · XLogP 8.2 · TPSA 124 Ų · H-bond donors 4
XLogP
8.2
TPSA
124 Ų
H-bond donors
4
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
44

SMILES CC[C@@H]1[C@@H]2C[C@@H](CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3[C@@H]1O)CC[C@@H]4[C@H](C)CCNC(=O)NS(=O)(=O)C5=CC=C(C=C5)C(C)(C)C)C)C)O

Computed descriptors from PubChem (CID 121428882), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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