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Compound Detail

CHEMBL1093423

LUSEOGLIFLOZIN
🧪 Phase II
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🧪 Phase II
CCOc1ccc(Cc2cc([C@@H]3S[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)cc2C)cc1

Basic Information

ChEMBL ID CHEMBL1093423
Name LUSEOGLIFLOZIN
Phase Phase II
Structure Type MOL
InChI Key WHSOLWOTCHFFBK-ZQGJOIPISA-N

Known Names

Luseogliflozin Luseogliflozina Luseogliflozine TS-071 TS-71 TS071
2
Targets
8
Activities
2
Assay Types
12
PK Parameters
20
Publications
6
Known Names
1
Indications

Molecular Properties

434.6
MW (Da)
2.22
ALogP
7
HBA
4
HBD
99.4
PSA (Ų)
0.53
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Single Enantiomer

Flags

Natural Product
USAN Stem -gliflozin

Extended Properties

Molecular Formula C23H30O6S
MW 434.55
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness 0.22

Indications

Diabetes Mellitus

ATC Classification

A10BK07
luseogliflozin
Level 1: ALIMENTARY TRACT AND METABOLISM
Level 2: DRUGS USED IN DIABETES

Activity Summary

IC50 6 meas. best 8.65
EC50 2 meas. best 8.64

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Sodium/glucose cotransporter 2
CHEMBL3884
IC50 8.65 8.6475 2.3 4
Sodium/glucose cotransporter 2
CHEMBL3884
EC50 8.64 8.64 2.3 1
Sodium/glucose cotransporter 1
CHEMBL4979
EC50 5.4 5.4 4000.0 1
Sodium/glucose cotransporter 1
CHEMBL4979
IC50 5.4 5.4 3990.0 2

Pharmacokinetic Data

Parameter Value Units Species
CL 36.3 mL.min-1.kg-1 Rattus norvegicus
CL 3.19 mL.min-1.kg-1 Canis lupus familiaris
Cmax 2103.33 nM Canis lupus familiaris
Cmax 82.15 nM Rattus norvegicus
F 35.3 % Rattus norvegicus
F 92.7 % Canis lupus familiaris
Fu 0.038 - Homo sapiens
T1/2 2.93 hr Rattus norvegicus
T1/2 4.07 hr Canis lupus familiaris
T1/2 7.0 hr Homo sapiens
Tmax 0.67 hr Canis lupus familiaris
Tmax 0.5 hr Rattus norvegicus

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
20302302 10.1021/jm901893x Rattus norvegicus 9
20302302 10.1021/jm901893x Canis familiaris 7
20302302 10.1021/jm901893x ADMET 2
31630053 10.1016/j.ejmech.2019.111773 Sodium/glucose cotransporter 2 2
20302302 10.1021/jm901893x Kidney 2
20302302 10.1021/jm901893x Plasma 2
20302302 10.1021/jm901893x Serum 2
20302302 10.1021/jm901893x Sodium/glucose cotransporter 1 1
20302302 10.1021/jm901893x Sodium/glucose cotransporter 2 1
20302302 10.1021/jm901893x Unchecked 1
20302302 10.1021/jm901893x Liver microsomes 1
20302302 10.1021/jm901893x Hepatocyte 1
20302302 10.1021/jm901893x Caco-2 1
29954682 10.1016/j.bmc.2018.06.017 Sodium/glucose cotransporter 2 1
31630053 10.1016/j.ejmech.2019.111773 Sodium/glucose cotransporter 1 1
31630053 10.1016/j.ejmech.2019.111773 ADMET 1
31630053 10.1016/j.ejmech.2019.111773 Unchecked 1
31930920 10.1021/acs.jmedchem.9b01701 Sodium/glucose cotransporter 1 1
31930920 10.1021/acs.jmedchem.9b01701 Sodium/glucose cotransporter 2 1
31325786 10.1016/j.ejmech.2019.07.032 Sodium/glucose cotransporter 2 1

Data from ChEMBL 36 via Core Engine