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BAY-876 | Inhibitor of SLC2A1
RATINGS:
Cellular Use: (2 reviews)

In Model Organisms: (2 reviews)
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary

Targets Biochemical/Biophysical Potency Cellular Potency
SLC2A1
  • IC50:2 nM
  • IC50:3.2 nM
Inhibitor
up to 100 nM

Selectivity

In Vitro Selectivity Assessment
Selectivity Assessment Description:
Selectivity within target family: the closest target is SLC2A4 which is >100x less selective (IC50 = ...

Potency
Cellular
In Vitro

SLC2A1

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

DOI Reference: 10.1002/cmdc.201600276

In Vivo Validations

Rat
Dose: 0.3 mg/Kg
Route of delivery: Intravenous
Plasma half life: 2.5 h
Systemic clearance: 0.23 (plasma), 0.33 (blood) L/h/Kg
Volume of Distribution at Steady-State: 0.79 L/Kg

DOI Reference: 10.1002/cmdc.201600276

Dose: 0.6 mg/Kg
Route of delivery: Oral
Cmax: 0.33 Kg/L
Bioavailability: 85%

DOI Reference: 10.1002/cmdc.201600276

Dog
Dose: 0.1 mg/Kg
Route of delivery: Intravenous
Plasma half life: 22 h
Systemic clearance: 0.033 (plasma), 0.059 (blood) L/h/Kg
Volume of Distribution at Steady-State: 1.0 L/Kg

DOI Reference: 10.1002/cmdc.201600276

Dose: 0.2 mg/Kg
Route of delivery: Oral
Cmax: 0.93 Kg/L
Bioavailability: 79%

DOI Reference: 10.1002/cmdc.201600276

Negative Control Compounds

BAY-588
Notes: IC50 SLC2A1 = 1.2 μM; clean GPCR scan

Chemical Information

Molecular Formula C24H16F4N6O2
SMILEs Cc1c(NC(=O)c2cc(C(N)=O)nc3cc(F)ccc23)c(C(F)(F)F)nn1Cc1ccc(C#N)cc1
InChI InChI=1S/C24H16F4N6O2/c1-12-20(21(24(26,27)28)33-34(12)11-14-4-2-13(10-29)3-5-14)32-23(36)17-9-19(22(30)35)31-18-8-15(25)6-7-16(17)18/h2-9H,11H2,1H3,(H2,30,35)(H,32,36)
Molecular weight 496.13 Da
AlogP 4.168800000000002
HBond acceptors 8
HBond donors 3
Atoms 52

Vendors

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Expert Reviews

by SERP
(on 29 Nov 2021 )
Cellular Use Rating
In Model Organisms
( The reviewer did not leave any comments )
by SERP
(on 3 Dec 2021 )
Cellular Use Rating
In Model Organisms
( The reviewer did not leave any comments )
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