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Compound Detail

CHEMBL38224

INDOLIDAN
🧪 Phase II
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🧪 Phase II
CC1(C)C(=O)Nc2ccc(C3=NNC(=O)CC3)cc21

Basic Information

ChEMBL ID CHEMBL38224
Name INDOLIDAN
Phase Phase II
Structure Type MOL
InChI Key LZCQFJKUAIWHRW-UHFFFAOYSA-N

Known Names

Indolidan LY 195115 LY-195115
3
Targets
7
Activities
2
Assay Types
3
PK Parameters
15
Publications
3
Known Names

Molecular Properties

257.3
MW (Da)
1.53
ALogP
3
HBA
2
HBD
70.6
PSA (Ų)
0.80
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral
USAN Stem -dan
USAN Year 1987

Extended Properties

Molecular Formula C14H15N3O2
MW 257.29
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.47

Activity Summary

IC50 5 meas. best 7.1
Ki 2 meas. best 8.27

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Phosphodiesterase 4
CHEMBL2093863
Ki 8.27 8.27 5.4 1
Phosphodiesterase 3
CHEMBL2094125
IC50 7.1 6.4533 80.0 3
Phosphodiesterase; PDE3 & PDE4
CHEMBL2095153
Ki 7.1 7.1 80.0 1
Phosphodiesterase; PDE3 & PDE4
CHEMBL2095153
IC50 6.89 6.89 130.0 1
Phosphodiesterase 4
CHEMBL2093863
IC50 6.82 6.82 150.0 1

Pharmacokinetic Data

Parameter Value Units Species
F 100.0 % Canis lupus familiaris
T1/2 8.0 hr Canis lupus familiaris
T1/2 14.0 hr Canis lupus familiaris

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
3761304 10.1021/jm00160a006 Canis familiaris 6
2153210 10.1021/jm00163a061 Canis familiaris 4
3033241 10.1021/jm00388a014 Canis familiaris 3
8388468 10.1021/jm00062a011 Phosphodiesterase 3 3
3031290 10.1021/jm00387a007 Canis familiaris 3
3761304 10.1021/jm00160a006 Felis catus 3
2544724 10.1021/jm00127a015 Canis familiaris 3
3033241 10.1021/jm00388a014 Phosphodiesterase; PDE3 & PDE4 2
2738882 10.1021/jm00127a014 Phosphodiesterase 4 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
1310113 10.1021/jm00079a022 Sarcoplasmic/endoplasmic reticulum calcium ATPase 2 1
2738882 10.1021/jm00127a014 Canis familiaris 1
3761304 10.1021/jm00160a006 ADMET 1
2153210 10.1021/jm00163a061 Phosphodiesterase 3 1
37077378 10.1021/acsmedchemlett.3c00092 Phosphodiesterase 3 1

Data from ChEMBL 36 via Core Engine