Compound Detail

CHEMBL2206187

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NCC[C@H](O)C(=O)N[C@@H]1C[C@H](N)[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2N)[C@H](O[C@@H]2O[C@H](CN)[C@@H](O)[C@H]2O)[C@H]1O.O=S(=O)(O)O

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL2206187
Phase	Preclinical
Structure Type	MOL
InChI Key	DXNFOEAYIOCVEY-KMFTYAMCSA-N
Parent Compound	CHEMBL511656
Active Moiety	CHEMBL511656

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

555.6

MW (Da)

-7.79

ALogP

HBA

HBD

311.7

PSA (Å²)

0.12

QED

Ro5 Violations

Rot. Bonds

First in Class Prodrug

IC50 5 meas. best 6.8

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Ribosome CHEMBL613299	IC50	6.8	5.3467	160.0	3
Unchecked CHEMBL612545	IC50	6.7	6.7	200.0	1

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Ribosome	IC50	=	160.0	nM	6.8	Inhibition of ribosome-mediated translation in prokaryotic system	-
Unchecked	IC50	=	200.0	nM	6.7	Inhibition of ribosome S30 subunit-mediated protein synthesis in Escherichia col...	23148581
Ribosome	IC50	=	24000.0	nM	4.62	Inhibition of ribosome-mediated protein synthesis in rabbit reticulocytes after ...	23148581
Ribosome	IC50	=	24000.0	nM	4.62	Inhibition of ribosome-mediated translation in eukaryotic system	-

PubMed	DOI	Target Context	# Activities
-	10.1039/C0MD00195C	Ribosome	6
-	10.1039/C0MD00195C	80S Ribosome	4
23148581	10.1021/jm3012992	Unchecked	3
23148581	10.1021/jm3012992	80S Ribosome	1
23148581	10.1021/jm3012992	Ribosome	1
23148581	10.1021/jm3012992	Escherichia coli	1
23148581	10.1021/jm3012992	HEK293	1
-	10.1039/C0MD00195C	HEK293	1
-	10.1039/C0MD00195C	HFF	1
-	10.1039/C0MD00195C	Bacillus spizizenii	1

Data from ChEMBL 36 via Core Engine