Compounds, activity concentration at/below 1 uM for PubChem BioAssay ( - PubChem Compound - NCBI

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Select item 1354498431.

an image of a chemical structure CID 135449843

CHEMBL1584730; HMS2440K06; AKOS027949307 ...

MW:: 348.400
MF:: C₁₉H₁₆N₄O₃

IUPAC name:: 2-[4-[4-(1H-benzimidazol-2-yl)-3-hydroxy-5-imino-2H-pyrrol-1...

Create Date:: 2019-01-15

CID:: 135449843

Summary Similar Compounds Same Parent, Connectivity

Select item 1354154352.

an image of a chemical structure CID 135415435

regid3712971; MLS000881076; CHEMBL3196509

MW:: 465.500
MF:: C₂₅H₁₉N₇OS

IUPAC name:: (Z)-2-(1H-benzimidazol-2-yl)-3-hydroxy-4-[[4-(2-methylphenyl...

Create Date:: 2019-01-15

CID:: 135415435

Summary Similar Compounds Same Parent, Connectivity

Select item 1354084053.

an image of a chemical structure CID 135408405

4-[[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester; MLS000110189; ethyl 4-[[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzoate ...

MW:: 347.400
MF:: C₁₆H₁₇N₃O₄S

IUPAC name:: ethyl 4-[[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acet...

Create Date:: 2019-01-15

CID:: 135408405

Summary Similar Compounds Same Parent, Connectivity

Select item 1354035724.

an image of a chemical structure CID 135403572

MLS000089953; CHEMBL240331; SMR000024571 ...

MW:: 328.300
MF:: C₁₆H₁₂N₂O₄S

IUPAC name:: 2-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-3H-quinazolin...

Create Date:: 2019-01-15

CID:: 135403572

Summary Similar Compounds Same Parent, Connectivity

Select item 546867645.

an image of a chemical structure CID 54686764

DEMECLOCYCLINE HYDROCHLORIDE; 64-73-3; Demeclocycline HCL ...

MW:: 501.300
MF:: C₂₁H₂₂Cl₂N₂O₈

IUPAC name:: (4S,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12...

Create Date:: 2011-12-26

CID:: 54686764

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 241782836.

an image of a chemical structure CID 24178283

AS-1029-64; CHEMBL1434189; BDBM42019 ...

MW:: 461.600
MF:: C₂₅H₂₇N₅O₂S

IUPAC name:: 2-[4-[6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]p...

Create Date:: 2008-02-26

CID:: 24178283

Summary Similar Compounds Same Parent, Connectivity

Select item 172825427.

an image of a chemical structure CID 17282542

JM2-11B; CHEMBL1597328; BDBM49158 ...

MW:: 331.500
MF:: C₁₈H₂₅N₃OS

IUPAC name:: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,6-d...

Create Date:: 2007-11-13

CID:: 17282542

Summary Similar Compounds Same Parent, Connectivity

Select item 95569458.

an image of a chemical structure CID 9556945

3-{2-[(hydroxyimino)methyl]-1H-pyrrol-1-yl}benzoic acid; CHEMBL1995948; 3-{2-[(E)-(hydroxyimino)methyl]-1H-pyrrol-1-yl}benzoic acid ...

MW:: 230.220
MF:: C₁₂H₁₀N₂O₃

IUPAC name:: 3-[2-[(E)-hydroxyiminomethyl]pyrrol-1-yl]benzoic acid

Create Date:: 2006-10-23

CID:: 9556945

Summary Similar Compounds Same Parent, Connectivity

Select item 95511089.

an image of a chemical structure CID 9551108

5-{[(4-methylphenyl)sulfonyl]methyl}furan-2-carboxylic acid; SMR000132396; MLS000521988 ...

MW:: 280.300
MF:: C₁₃H₁₂O₅S

IUPAC name:: 5-[(4-methylphenyl)sulfonylmethyl]furan-2-carboxylic acid

Create Date:: 2006-10-20

CID:: 9551108

Summary Similar Compounds Same Parent, Connectivity

Select item 661950410.

an image of a chemical structure CID 6619504

SMR000127759; MLS000522492; ChemDiv2_006487 ...

MW:: 395.500
MF:: C₂₂H₂₁NO₄S

IUPAC name:: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[(4-methylphenyl)sulfonyl...

Create Date:: 2006-06-05

CID:: 6619504

Summary Similar Compounds Same Parent, Connectivity

Select item 660284111.

an image of a chemical structure CID 6602841

MLS000047960; SMR000033958; regid4247900 ...

MW:: 364.800
MF:: C₁₈H₂₁ClN₂O₄

IUPAC name:: (3R,4S,5S)-2-(6,8-dimethylpyrrolo[2,3-g]quinolin-1-yl)oxane-...

Create Date:: 2006-05-25

CID:: 6602841

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 574257412.

an image of a chemical structure CID 5742574

CHEMBL3195986; SCHEMBL13856440; HMS2485O19

MW:: 297.400
MF:: C₁₁H₁₅N₅OS₂

IUPAC name:: (E)-3-amino-2-[2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-y...

Create Date:: 2005-07-30

CID:: 5742574

Summary Similar Compounds Same Parent, Connectivity

Select item 574247913.

an image of a chemical structure CID 5742479

CHEMBL3189442; HMS2462F06

MW:: 330.400
MF:: C₁₅H₁₄N₄O₃S

IUPAC name:: (E)-3-amino-2-[2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]...

Create Date:: 2005-07-30

CID:: 5742479

Summary Similar Compounds Same Parent, Connectivity

Select item 574245014.

an image of a chemical structure CID 5742450

CHEMBL3208465; HMS2438F15

MW:: 314.370
MF:: C₁₄H₁₄N₆OS

IUPAC name:: (E)-3-amino-2-[2-[1-(4-methylphenyl)tetrazol-5-yl]sulfanylac...

Create Date:: 2005-07-30

CID:: 5742450

Summary Similar Compounds Same Parent, Connectivity

Select item 543192715.

an image of a chemical structure CID 5431927

CHEMBL1990772; N'-[1-(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)ethylidene]-3-hydroxy-2-naphthohydrazide; AKOS000485106 ...

MW:: 372.400
MF:: C₂₂H₁₆N₂O₄

IUPAC name:: N-[(Z)-1-(1,3-dioxoinden-2-yl)ethylideneamino]-3-hydroxynaph...

Create Date:: 2005-07-09

CID:: 5431927

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 534498816.

an image of a chemical structure CID 5344988

MLS000033816; SMR000011486; 4-(2-Diethylamino-ethyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid benzyl ester ...

MW:: 409.400
MF:: C₂₀H₂₉BrN₂O₂

IUPAC name:: benzyl 4-[2-(diethylamino)ethyl]-3,5-dimethyl-1H-pyrrole-2-c...

Create Date:: 2006-02-02

CID:: 5344988

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 531004017.

an image of a chemical structure CID 5310040

MLS000103811; 868965-59-7; SMR000017667 ...

MW:: 357.500
MF:: C₁₇H₁₅N₃O₂S₂

IUPAC name:: N-[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-...

Create Date:: 2005-12-09

CID:: 5310040

Summary Similar Compounds Same Parent, Connectivity

Select item 530987518.

an image of a chemical structure CID 5309875

MLS000120697; 2-(4-methoxyphenyl)-3-oxo-1H-isoindole-4-carboxylic acid; SMR000097540 ...

MW:: 283.280
MF:: C₁₆H₁₃NO₄

IUPAC name:: 2-(4-methoxyphenyl)-3-oxo-1H-isoindole-4-carboxylic acid

Create Date:: 2005-12-09

CID:: 5309875

Summary Similar Compounds Same Parent, Connectivity

Select item 530924319.

an image of a chemical structure CID 5309243

MLS000119803; SMR000096724; SR-01000137786 ...

MW:: 298.400
MF:: C₁₇H₂₂N₄O

IUPAC name:: N-[4-(dimethylamino)phenyl]-2-(4,5,6,7-tetrahydroindazol-2-y...

Create Date:: 2005-12-09

CID:: 5309243

Summary Similar Compounds Same Parent, Connectivity

Select item 530922220.

an image of a chemical structure CID 5309222

SMR000095048; MLS000118100; CHEMBL1469865 ...

MW:: 375.400
MF:: C₂₁H₁₇N₃O₄

IUPAC name:: N-(1,3-benzodioxol-5-yl)-1,5-dimethyl-4-oxopyrrolo[3,2-c]qui...

Create Date:: 2005-12-09

CID:: 5309222

Summary Similar Compounds Same Parent, Connectivity

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Chemical Properties

Rule of 5 (113)
Compounds satisfied Lipinski's Rule of Five in evaluating druglikeness. Query: (-5:5[LOGP]) AND (0:500[MOLWT]) AND (0:5[HBDC]) AND (0:10[HBAC]).

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Compounds identified as active in screening experiments

BioAssays, Tested (120)
Compounds identified as tested in screening experiments

Protein 3D Structures (1)
Compounds bound to proteins in atructure biology experiments

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Pharmacological Actions (2)
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