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Compound Summary

Compound Information

ibudilast

Compound Name:	ibudilast
Compound CID:	3671
Synonyms:	ibudilast 50847-11-5 Ketas KC-404 Ibudilastum More...
Iupac Name:	2-methyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one
InChI:	InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3
InChIKey:	ZJVFLBOZORBYFE-UHFFFAOYSA-N
Canonical Smiles:	CC(C)C1=NN2C=CC=CC2=C1C(=O)C(C)C
Isomeric Smiles:	CC(C)C1=NN2C=CC=CC2=C1C(=O)C(C)C
Molecular Weight:	230.31
Molecular Formula:	C14H18N2O

Compound Structure

2D Structure:

3D Structure:

Computed Properties

ibudilast

Molecular Weight:	230.31
Molecular Formula:	C14H18N2O
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	3
Heavy Atom Count:	17
Complexity:	288

Synonyms

ibudilast

ibudilast	ibudilast
ibudilast	50847-11-5
Ketas	KC-404
Ibudilastum	Ke Tas
Ibudilastum Latin	MN-166
Ibudilast INN:JAN	Eyevinal
AV-411	UNII-M0TTH61XC5
Ketas (TN)	3-Isobutyryl-2-isopropylpyrazolo1,5-apyridine
2-methyl-1-(2-propan-2-ylpyrazolo1,5-apyridin-3-yl)propan-1-one	1-(2-isopropylpyrazolo1,5-apyridin-3-yl)-2-methylpropan-1-one
3-Isobutyryl-2-isopropylpyrazolo(1,5-a)pyridine	Tocris-1694
Lopac-I-0157	1-Propanone, 2-methyl-1-2-(1-methylethyl)pyrazolo1,5-apyridin-3-yl-
2-Isopropyl-3-isobutyrylpyrazolo(1,5-a)pyridine	AV411
MFCD00864808	M0TTH61XC5
CHEMBL19449	KC-404;AV-411;MN-166
NCGC00015542-05	2-Methyl-1-2-(Propan-2-Yl)pyrazolo1,5-Apyridin-3-Ylpropan-1-One
1-Propanone, 2-methyl-1-(2-(1-methylethyl)pyrazolo(1,5-a)pyridin-3-yl)-	DSSTox_CID_28933
DSSTox_RID_83199	2-isopropyl-3-isobutyrylpyrazolo1,5-apyridine
DSSTox_GSID_49007	Ibudilast (JAN/INN)
CAS-50847-11-5	SR-01000075927
AV 411	BRN 0656579
Pinatos	I0157_SIGMA
Ibudilast,(S)	Pyrazolo(1,5-a)pyridine, 3-isobutyryl-2-isopropyl-
1-(2-Isopropylpyrazolo(1,5-a)pyridin-3-yl)-2-methyl-1-propanone	Ibudilast (JP17/INN)
I 0157	Lopac0_000599
SCHEMBL30390	5-24-03-00396 (Beilstein Handbook Reference)
cc-407	MLS000862198
GTPL7399	ZINC4234
DTXSID7049007	CHEBI:31684
BCPP000209	HMS2089B21
HMS2233H08	HMS3261H20
HMS3268O11	HMS3374P02
HMS3412B20	HMS3676B20
HMS3715L09	HMS3886M03
BCP02335	HY-B0763
Tox21_113503	Tox21_500599
BDBM50240404	s4837
SBB056343	Ibudilast, >=99% (HPLC), solid
2-Methyl-1-2-(1-methylethyl)pyrazolo1,5-apyridin-3-yl 1-propanone	AKOS015895123
Tox21_113503_1	AC-1044
BCP9000768	CCG-204688
DB05266	LP00599
SB19092	SDCCGSBI-0050581.P002
NCGC00015542-01	NCGC00015542-02
NCGC00015542-03	NCGC00015542-04
NCGC00015542-06	NCGC00015542-07
NCGC00015542-17	NCGC00025261-01
NCGC00025261-02	NCGC00025261-03
NCGC00025261-04	NCGC00261284-01
SMR000326961	SY051343
AB0007937	EU-0100599
FT-0654591	FT-0670255
I0740	D01385
F20666	AB00698306-06
3-Isobutyryl-2-isopropyl-Pyrazolo(1,5-a)pyridine	847I115
A828320	H-20256
L003042	Q261167
J-512714	SR-01000075927-1
SR-01000075927-3	SR-01000075927-6
BRD-K16444452-001-03-4	1-(2-isopropylH-pyrazolo1,5-apyridin-3-yl)-2-methylpropan-1-one
1-(2-Isopropyl-pyrazolo1,5-apyridin-3-yl)-2-methyl-propan-1-one	1-(2-Isopropyl-pyrazolo1,5-alphapyridin-3-yl)-2-methyl-propan-1-one
1-(2-isopropylpyrazolo1,5-alphapyridin-3-yl)-2-methylpropan-1-one	2-methyl-1-(2-propan-2-yl-3-pyrazolo1,5-apyridinyl)-1-propanone
2-methyl-1-2-(1-methylethyl)pyrazolo1,5-apyridin-3-yl-1-propanone	(Ibudilast)1-(2-Isopropyl-pyrazolo1,5-apyridin-3-yl)-2-methyl-propan-1-one
1-(2-Isopropylpyrazolo1,5-apyridin-3-yl)-2-methylpropan-1-one (Ibudilast)	2-methyl-1-2-(methylethyl)(8-hydropyrazolo1,5-apyridin-3-yl)propan-1-one
AVL

Experimental Data

ibudilast

Species	Dosage	Unit	CG Lifespan(AVG/MED days)	TG Lifespan(AVG/MED days)	Lifespan Change(AVG/MED%)	CG Lifespan(MAX days)	TG Lifespan(MAX days)	Lifespan Change(MAX%)	Significant	Strain	Gender	PubMed	Active Label
Caenorhabditis elegans	33	umol/L			2				NS	N2		24134630	Inactive

Experimental Data Visualization

ibudilast

Statistics Data

ibudilast

Species	Lifespan Change(AVG/MED%)	Lifespan Change(MAX%)	Count Reference	Count Data point
Caenorhabditis elegans	2		1	1

Statistics Data Visualization

ibudilast

Compound Name:

ibudilast

Compound CID:

3671

Synonyms:

ibudilast 50847-11-5 Ketas KC-404 Ibudilastum More...

Iupac Name:

2-methyl-1-(2-propan-2-ylpyrazolo[1,5-a]pyridin-3-yl)propan-1-one

InChI:

InChI=1S/C14H18N2O/c1-9(2)13-12(14(17)10(3)4)11-7-5-6-8-16(11)15-13/h5-10H,1-4H3

InChIKey:

ZJVFLBOZORBYFE-UHFFFAOYSA-N

Canonical Smiles:

CC(C)C1=NN2C=CC=CC2=C1C(=O)C(C)C

Isomeric Smiles:

CC(C)C1=NN2C=CC=CC2=C1C(=O)C(C)C

Molecular Weight:

230.31

Molecular Formula:

C14H18N2O

Molecular Weight:

230.31

Molecular Formula:

C14H18N2O

Hydrogen Bond Donor Count:

0

Hydrogen Bond Acceptor Count:

2

Rotatable Bond Count:

3

Heavy Atom Count:

17

Complexity:

288

ibudilast

50847-11-5

Ketas

KC-404

Ibudilastum

Ke Tas

Ibudilastum Latin

MN-166

Ibudilast INN:JAN

Eyevinal

AV-411

UNII-M0TTH61XC5

Ketas (TN)

3-Isobutyryl-2-isopropylpyrazolo1,5-apyridine

2-methyl-1-(2-propan-2-ylpyrazolo1,5-apyridin-3-yl)propan-1-one

1-(2-isopropylpyrazolo1,5-apyridin-3-yl)-2-methylpropan-1-one

3-Isobutyryl-2-isopropylpyrazolo(1,5-a)pyridine

Tocris-1694

Lopac-I-0157

1-Propanone, 2-methyl-1-2-(1-methylethyl)pyrazolo1,5-apyridin-3-yl-

2-Isopropyl-3-isobutyrylpyrazolo(1,5-a)pyridine

AV411

MFCD00864808

M0TTH61XC5

CHEMBL19449

KC-404;AV-411;MN-166

NCGC00015542-05

2-Methyl-1-2-(Propan-2-Yl)pyrazolo1,5-Apyridin-3-Ylpropan-1-One

1-Propanone, 2-methyl-1-(2-(1-methylethyl)pyrazolo(1,5-a)pyridin-3-yl)-

DSSTox_CID_28933

DSSTox_RID_83199

2-isopropyl-3-isobutyrylpyrazolo1,5-apyridine

DSSTox_GSID_49007

Ibudilast (JAN/INN)

CAS-50847-11-5

SR-01000075927

AV 411

BRN 0656579

Pinatos

I0157_SIGMA

Ibudilast,(S)

Pyrazolo(1,5-a)pyridine, 3-isobutyryl-2-isopropyl-

1-(2-Isopropylpyrazolo(1,5-a)pyridin-3-yl)-2-methyl-1-propanone

Ibudilast (JP17/INN)

I 0157

Lopac0_000599

ibudilast

50847-11-5

Ketas

KC-404

Ibudilastum

More...