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

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Select item 1359534021.

an image of a chemical structure CID 135953402

IR-KT; MLS000560191; HMS2202M14 ...

MW:: 974.600
MF:: C₄₃H₇₄ClN₁₈O₆⁺

IUPAC name:: 3-[1-[(2S,3S)-1-[4-[4-[4-[(2S)-6-azaniumyl-2-[4-(2-hydroxypr...

Create Date:: 2019-01-19

CID:: 135953402

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1359534012.

an image of a chemical structure CID 135953401

AR-IK; MLS000560130; HMS2202O12 ...

MW:: 930.600
MF:: C₄₁H₇₀ClN₁₈O₅⁺

IUPAC name:: 3-[1-[(2S)-1-[4-[4-[4-[(2S,3S)-2-[4-(4-azaniumylbutyl)triazo...

Create Date:: 2019-01-19

CID:: 135953401

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1359534003.

an image of a chemical structure CID 135953400

GR-KI; MLS000560226; HMS2202O04 ...

MW:: 916.500
MF:: C₄₀H₆₈ClN₁₈O₅⁺

IUPAC name:: 3-[1-[2-[4-[4-[4-[(2S)-6-azaniumyl-2-(4-butyltriazol-1-yl)he...

Create Date:: 2019-01-19

CID:: 135953400

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1359533994.

an image of a chemical structure CID 135953399

IR-GK; MLS000560183; HMS2202M16 ...

MW:: 916.500
MF:: C₄₀H₆₈ClN₁₈O₅⁺

IUPAC name:: 3-[1-[(2S,3S)-1-[4-[4-[4-[2-[4-(4-azaniumylbutyl)triazol-1-y...

Create Date:: 2019-01-19

CID:: 135953399

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1359533985.

an image of a chemical structure CID 135953398

IR-IK; MLS000560178; SMR000127369 ...

MW:: 972.600
MF:: C₄₄H₇₆ClN₁₈O₅⁺

IUPAC name:: 3-[1-[(2S,3S)-1-[4-[4-[4-[(2S,3S)-2-[4-(4-azaniumylbutyl)tri...

Create Date:: 2019-01-19

CID:: 135953398

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1359533946.

an image of a chemical structure CID 135953394

GR-IK; MLS000560029; HMS2202M22 ...

MW:: 916.500
MF:: C₄₀H₆₈ClN₁₈O₅⁺

IUPAC name:: 3-[1-[2-[4-[4-[4-[(2S,3S)-2-[4-(4-azaniumylbutyl)triazol-1-y...

Create Date:: 2019-01-19

CID:: 135953394

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1359324267.

an image of a chemical structure CID 135932426

MLS002179764; CHEMBL1733722; HMS3071G06 ...

MW:: 480.900
MF:: C₂₂H₂₀ClF₃N₄O₃

IUPAC name:: N-[2-[4-chloro-3-(trifluoromethyl)anilino]-2-oxoethyl]-N-met...

Create Date:: 2019-01-19

CID:: 135932426

Summary Similar Compounds Same Parent, Connectivity

Select item 1359005498.

an image of a chemical structure CID 135900549

MLS001240969; SCHEMBL3067269; CHEMBL3197295 ...

MW:: 332.400
MF:: C₁₉H₁₆N₄O₂

IUPAC name:: N'-(2-hydroxyanilino)-N-(2-hydroxyphenyl)iminobenzenecarboxi...

Create Date:: 2019-01-18

CID:: 135900549

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 1359000899.

an image of a chemical structure CID 135900089

IR-ID; MLS000560142; SMR000127367

MW:: 972.600
MF:: C₄₃H₇₀ClN₁₇O₇

IUPAC name:: 3-[1-[(2S,3S)-1-[4-[4-[4-[(2S,3S)-2-[4-(2-carboxyethyl)triaz...

Create Date:: 2019-01-18

CID:: 135900089

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13590008310.

an image of a chemical structure CID 135900083

GR-GS; MLS000560045; SMR000127356

MW:: 832.400
MF:: C₃₄H₅₄ClN₁₇O₆

IUPAC name:: diaminomethylidene-[3-[1-[2-[4-[4-[4-[2-[4-(2-hydroxyethyl)t...

Create Date:: 2019-01-18

CID:: 135900083

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13589630211.

an image of a chemical structure CID 135896302

MLS002234113; CHEMBL1727961; KUC103064N ...

MW:: 449.000
MF:: C₂₆H₂₉ClN₄O

IUPAC name:: (2S,4'S,8'R,13'R)-3-benzylimino-7-chlorospiro[1,4-dihydroqui...

Create Date:: 2019-01-18

CID:: 135896302

Summary Similar Compounds Same Parent, Connectivity

Select item 13587551112.

an image of a chemical structure CID 135875511

MLS001078207; CHEMBL1594018; HMS3001I16 ...

MW:: 333.400
MF:: C₂₀H₁₉N₃O₂

IUPAC name:: 2-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-3H-quinazol...

Create Date:: 2019-01-18

CID:: 135875511

Summary Similar Compounds Same Parent, Connectivity

Select item 13587145013.

an image of a chemical structure CID 135871450

MLS000829959; SMR000672029; CHEMBL1406465 ...

MW:: 519.400
MF:: C₂₇H₂₇BrN₄O₂

IUPAC name:: methyl (6S)-3-benzyl-6-(4-bromophenyl)-4-methyl-2-(2-pyridin...

Create Date:: 2019-01-18

CID:: 135871450

Summary Similar Compounds Same Parent, Connectivity

Select item 13587094914.

an image of a chemical structure CID 135870949

MLS001156809; CHEMBL1551839; HMS3020I21 ...

MW:: 364.400
MF:: C₂₀H₂₀N₄O₃

IUPAC name:: 4-ethyl-N'-[3-(4-oxo-3H-quinazolin-2-yl)propanoyl]benzohydra...

Create Date:: 2019-01-18

CID:: 135870949

Summary Similar Compounds Same Parent, Connectivity

Select item 13587093215.

an image of a chemical structure CID 135870932

MLS001157542; CHEMBL1314964; HMS3008D21 ...

MW:: 471.500
MF:: C₂₁H₂₁N₅O₆S

IUPAC name:: 2-[3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxopropyl]-...

Create Date:: 2019-01-18

CID:: 135870932

Summary Similar Compounds Same Parent, Connectivity

Select item 13587093116.

an image of a chemical structure CID 135870931

MLS001160831; CHEMBL1905885; HMS3008K15 ...

MW:: 453.900
MF:: C₁₉H₁₇ClFN₃O₅S

IUPAC name:: [1-(2-chloro-4-fluoroanilino)-1-oxopropan-2-yl] 3-[(1,1-diox...

Create Date:: 2019-01-18

CID:: 135870931

Summary Similar Compounds Same Parent, Connectivity

Select item 13585857417.

an image of a chemical structure CID 135858574

MLS001159726; CHEMBL1590023; HMS3038B14 ...

MW:: 429.900
MF:: C₂₁H₂₀ClN₃O₅

IUPAC name:: [2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl] 3-(4-oxo...

Create Date:: 2019-01-18

CID:: 135858574

Summary Similar Compounds Same Parent, Connectivity

Select item 13585333618.

an image of a chemical structure CID 135853336

898431-66-8; MLS001239100; CHEMBL1713708 ...

MW:: 324.360
MF:: C₁₃H₁₆N₄O₄S

IUPAC name:: 7-hydroxy-N-(2-morpholin-4-ylethyl)-5-oxo-[1,3]thiazolo[3,2-...

Create Date:: 2019-01-18

CID:: 135853336

Summary Similar Compounds Same Parent, Connectivity

Select item 13585330619.

an image of a chemical structure CID 135853306

MLS001234035; CHEMBL1473274; HMS1657I16 ...

MW:: 295.320
MF:: C₁₂H₁₃N₃O₄S

IUPAC name:: 7-hydroxy-5-oxo-N-(oxolan-2-ylmethyl)-[1,3]thiazolo[3,2-a]py...

Create Date:: 2019-01-18

CID:: 135853306

Summary Similar Compounds Same Parent, Connectivity

Select item 13585330420.

an image of a chemical structure CID 135853304

MLS001234015; SMR000811825; 898431-56-6 ...

MW:: 335.400
MF:: C₁₆H₂₁N₃O₃S

IUPAC name:: 7-hydroxy-5-oxo-N-(3,3,5-trimethylcyclohexyl)-[1,3]thiazolo[...

Create Date:: 2019-01-18

CID:: 135853304

Summary Similar Compounds Same Parent, Connectivity

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Chemical Properties

Rule of 5 (10,503)
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 probe reagents in screening experiments
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Compounds identified as active in screening experiments

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Protein 3D Structures (165)
Compounds bound to proteins in atructure biology experiments

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