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

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Items: 19

Select item 469023551.

an image of a chemical structure CID 46902355

MLS002920945; SMR001798410; (2S,3R,12bS)-2-((benzo[d][1,3]dioxol-5-ylmethyl)(methyl)amino)-3-((S)-1-hydroxyethyl)-1,2,3,6,7,12b-hexahydroindolo[2,3-a]quinolizin-4(12H)-one ...

MW:: 447.500
MF:: C₂₆H₂₉N₃O₄

IUPAC name:: (2S,3R,12bS)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-3-[...

Create Date:: 2010-10-05

CID:: 46902355

Summary Similar Compounds Same Parent, Connectivity

Select item 469023342.

an image of a chemical structure CID 46902334

MLS002920921; SMR001798386; (2S,3R,12bS)-2-((3,5-dichlorobenzyl)(methyl)amino)-3-(hydroxymethyl)-1,2,3,6,7,12b-hexahydroindolo[2,3-a]quinolizin-4(12H)-one ...

MW:: 458.400
MF:: C₂₄H₂₅Cl₂N₃O₂

IUPAC name:: (2S,3R,12bS)-2-[(3,5-dichlorophenyl)methyl-methylamino]-3-(h...

Create Date:: 2010-10-05

CID:: 46902334

Summary Similar Compounds Same Parent, Connectivity

Select item 445111633.

an image of a chemical structure CID 44511163

CHEMBL3182924; SR-03000003192; SR-03000003192-1 ...

MW:: 477.600
MF:: C₂₆H₂₇N₃O₄S

IUPAC name:: (2R,4R)-N-(1H-benzimidazol-2-ylmethyl)-4-(1-benzothiophen-3-...

Create Date:: 2009-12-18

CID:: 44511163

Summary Similar Compounds Same Parent, Connectivity

Select item 249791554.

an image of a chemical structure CID 24979155

MLS001079903; SMR000709923; CHEMBL1572227 ...

MW:: 414.800
MF:: C₁₈H₁₅ClN₆O₄

IUPAC name:: N-[2-(4-chloroanilino)-2-oxoethyl]-N-methyl-3-nitro-4-(1,2,4...

Create Date:: 2008-10-27

CID:: 24979155

Summary Similar Compounds Same Parent, Connectivity

Select item 247936145.

an image of a chemical structure CID 24793614

MLS001220202; SMR000607018; N-(3-Methoxy-phenyl)-2-(8-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)-acetamide ...

MW:: 379.400
MF:: C₁₉H₁₇N₅O₂S

IUPAC name:: N-(3-methoxyphenyl)-2-[(8-methyl-5H-[1,2,4]triazino[5,6-b]in...

Create Date:: 2008-05-20

CID:: 24793614

Summary Similar Compounds Same Parent, Connectivity

Select item 247923866.

an image of a chemical structure CID 24792386

MLS001222003; SMR000607036; 2-(8-Fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)-N-(4-methoxy-benzyl)-acetamide ...

MW:: 397.400
MF:: C₁₉H₁₆FN₅O₂S

IUPAC name:: 2-[(8-fluoro-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N...

Create Date:: 2008-05-20

CID:: 24792386

Summary Similar Compounds Same Parent, Connectivity

Select item 163991327.

an image of a chemical structure CID 16399132

MLS001164842; SMR000540128; CHEMBL1428675 ...

MW:: 434.400
MF:: C₂₃H₂₂N₄O₅

IUPAC name:: (8S)-6-(3-hydroxypropyl)-2-(3-nitrophenyl)-3,6,17-triazatetr...

Create Date:: 2007-07-30

CID:: 16399132

Summary Similar Compounds Same Parent, Connectivity

Select item 163987768.

an image of a chemical structure CID 16398776

MLS001164854; SMR000540129; CHEMBL1611018 ...

MW:: 390.400
MF:: C₂₁H₁₈N₄O₄

IUPAC name:: (8S)-6-methyl-2-(3-nitrophenyl)-3,6,17-triazatetracyclo[8.7....

Create Date:: 2007-07-30

CID:: 16398776

Summary Similar Compounds Same Parent, Connectivity

Select item 163986699.

an image of a chemical structure CID 16398669

MLS001164843; SMR000540138; CHEMBL1428879 ...

MW:: 476.500
MF:: C₂₆H₂₈N₄O₅

IUPAC name:: (8S)-2-(3-nitrophenyl)-6-(3-propan-2-yloxypropyl)-3,6,17-tri...

Create Date:: 2007-07-30

CID:: 16398669

Summary Similar Compounds Same Parent, Connectivity

Select item 1619698510.

an image of a chemical structure CID 16196985

MLS000834573; SMR000442110; CHEMBL1365838 ...

MW:: 500.400
MF:: C₂₄H₂₆BrN₃O₄

IUPAC name:: (2S,4S)-N-(1H-benzimidazol-2-ylmethyl)-4-(4-bromophenyl)-2-(...

Create Date:: 2007-07-05

CID:: 16196985

Summary Similar Compounds Same Parent, Connectivity

Select item 1619318111.

an image of a chemical structure CID 16193181

MLS000730072; SMR000308349; 3-{4-[4-(4-acetylphenyl)piperazin-1-yl]-4-oxobutyl}-6-bromoquinazoline-2,4(1H,3H)-dione ...

MW:: 513.400
MF:: C₂₄H₂₅BrN₄O₄

IUPAC name:: 3-[4-[4-(4-acetylphenyl)piperazin-1-yl]-4-oxobutyl]-6-bromo-...

Create Date:: 2007-07-05

CID:: 16193181

Summary Similar Compounds Same Parent, Connectivity

Select item 577042012.

an image of a chemical structure CID 5770420

MLS000121584; N-(1,3-benzodioxol-5-yl)-2-[(8-methoxy-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide; N-(1,3-benzodioxol-5-yl)-2-[(8-methoxy-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetamide ...

MW:: 409.400
MF:: C₁₉H₁₅N₅O₄S

IUPAC name:: N-(1,3-benzodioxol-5-yl)-2-[(8-methoxy-5H-[1,2,4]triazino[5,...

Create Date:: 2005-07-10

CID:: 5770420

Summary Similar Compounds Same Parent, Connectivity

Select item 414369313.

an image of a chemical structure CID 4143693

MLS000417440; SMR000242622; 1-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-phenyl-urea ...

MW:: 397.400
MF:: C₂₀H₁₉N₃O₄S

IUPAC name:: 1-[3-[(2-methoxyphenyl)sulfamoyl]phenyl]-3-phenylurea

Create Date:: 2005-09-13

CID:: 4143693

Summary Similar Compounds Same Parent, Connectivity

Select item 371885214.

an image of a chemical structure CID 3718852

Oprea1_540310; MLS003901997; CHEMBL1342842 ...

MW:: 508.400
MF:: C₂₅H₂₂BrN₃O₂S

IUPAC name:: 1-[1-(4-bromophenyl)-2,5-dioxopyrrolidin-3-yl]-3-phenyl-1-(2...

Create Date:: 2005-09-10

CID:: 3718852

Summary Similar Compounds Same Parent, Connectivity

Select item 310743015.

an image of a chemical structure CID 3107430

CHEMBL1374648; HMS2874M09; SR-01000816596 ...

MW:: 406.200
MF:: C₁₇H₁₆BrN₃O₄

IUPAC name:: N-[[4-(3-bromoanilino)-4-oxobutan-2-ylidene]amino]-2,4-dihyd...

Create Date:: 2005-08-09

CID:: 3107430

Summary Similar Compounds Same Parent, Connectivity

Select item 297319516.

an image of a chemical structure CID 2973195

MLS001035577; SMR000669238; CHEMBL1868869 ...

MW:: 459.400
MF:: C₂₃H₂₀F₃N₃O₄

IUPAC name:: 2-[3-(2-morpholin-4-yl-2-oxoacetyl)indol-1-yl]-N-[3-(trifluo...

Create Date:: 2005-07-29

CID:: 2973195

Summary Similar Compounds Same Parent, Connectivity

Select item 111675917.

an image of a chemical structure CID 1116759

SMR000120636; MLS000528062; 2-[5-(2,4-Dichloro-phenyl)-[1,3,4]oxadiazol-2-ylsulfanylmethyl]-1H-benzoimidazole ...

MW:: 377.200
MF:: C₁₆H₁₀Cl₂N₄OS

IUPAC name:: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-5-(2,4-dichlorophenyl...

Create Date:: 2005-07-10

CID:: 1116759

Summary Similar Compounds Same Parent, Connectivity

Select item 94807218.

an image of a chemical structure CID 948072

MLS001205596; SMR000518055; 2-[(1H-Benzoimidazol-2-ylamino)-methyl]-4,6-dichloro-phenol ...

MW:: 308.200
MF:: C₁₄H₁₁Cl₂N₃O

IUPAC name:: 2-[(1H-benzimidazol-2-ylamino)methyl]-4,6-dichlorophenol

Create Date:: 2005-07-09

CID:: 948072

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 70783719.

an image of a chemical structure CID 707837

N-[2-(1H-benzimidazol-2-yl)ethyl]-4-chloro-3-nitrobenzamide; MLS000571934; 301682-03-1 ...

MW:: 344.750
MF:: C₁₆H₁₃ClN₄O₃

IUPAC name:: N-[2-(1H-benzimidazol-2-yl)ethyl]-4-chloro-3-nitrobenzamide

Create Date:: 2005-07-08

CID:: 707837

Summary Similar Compounds Same Parent, Connectivity

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Chemical Properties

Rule of 5 (16)
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]).

BioActivity Experiments

BioAssays, Active (19)
Compounds identified as active in screening experiments

BioAssays, Tested (19)
Compounds identified as tested in screening experiments

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Compounds, activity concentration at/below 1 uM for PubChem BioAs... (19)
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