Compounds, Active for PubChem BioAssay (Select 1259418) - PubChem Compound - NCBI

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Select item 1362111061.

an image of a chemical structure CID 136211106

3-{5-[5-(5-CHLORO-1H-INDOL-2-YL)-1,2,4-OXADIAZOL-3-YL]-1H-1,3-BENZODIAZOL-1-YL}-1-(PYRROLIDIN-1-YL)PROPAN-1-ONE; AKOS021942979; BRD-K67585230-001-01-5

MW:: 460.900
MF:: C₂₄H₂₁ClN₆O₂

IUPAC name:: 3-[5-[5-(5-chloro-1H-indol-2-yl)-1,2,4-oxadiazol-3-yl]benzim...

Create Date:: 2019-01-21

CID:: 136211106

Summary Similar Compounds Same Parent, Connectivity

Select item 1361128242.

an image of a chemical structure CID 136112824

HMS4081C20; BRD-K18001011-001-01-8; BRD-K18001011-001-02-6 ...

MW:: 353.400
MF:: C₂₀H₂₃N₃O₃

IUPAC name:: 7-[1-(methoxymethyl)cyclobutanecarbonyl]-2-phenyl-3,5,6,8-te...

Create Date:: 2019-01-21

CID:: 136112824

Summary Similar Compounds Same Parent, Connectivity

Select item 1360799343.

an image of a chemical structure CID 136079934

1113122-27-2; 2-[8-[(2-ethylphenyl)thio]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-methylphenyl)acetamide; 6-[(4-fluorophenyl)methyl]-2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one ...

MW:: 492.600
MF:: C₂₆H₂₅FN₄O₃S

IUPAC name:: 6-[(4-fluorophenyl)methyl]-2-[[2-(4-methoxyphenyl)-5-methyl-...

Create Date:: 2019-01-21

CID:: 136079934

Summary Similar Compounds Same Parent, Connectivity

Select item 1360798804.

an image of a chemical structure CID 136079880

6-BENZYL-2-{[(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)METHYL]SULFANYL}-3H,4H,5H,6H,7H,8H-PYRIDO[4,3-D]PYRIMIDIN-4-ONE; AKOS005044173; BRD-K57224505-001-01-1

MW:: 444.600
MF:: C₂₅H₂₄N₄O₂S

IUPAC name:: 6-benzyl-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfany...

Create Date:: 2019-01-21

CID:: 136079880

Summary Similar Compounds Same Parent, Connectivity

Select item 1359349245.

an image of a chemical structure CID 135934924

170902-81-5; Fosaprepitant Impurity 1; 3-((3,5-bis(trifluoromethyl)phenethoxy)(4-fluorophenyl)(morpholino)methyl)-1H-1,2,4-triazol-5(4H)-one ...

MW:: 534.400
MF:: C₂₃H₂₁F₇N₄O₃

IUPAC name:: 3-[[(2R,3S)-2-[(1S)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy...

Create Date:: 2019-01-19

CID:: 135934924

Summary Similar Compounds Same Parent, Connectivity

Select item 1355650826.

an image of a chemical structure CID 135565082

Talazoparib; 1207456-01-6; BMN-673 ...

MW:: 380.400
MF:: C₁₉H₁₄F₂N₆O

IUPAC name:: (11S,12R)-7-fluoro-11-(4-fluorophenyl)-12-(2-methyl-1,2,4-tr...

Create Date:: 2019-01-15

CID:: 135565082

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

Select item 1346905277.

an image of a chemical structure CID 134690527

BRD-K64451397-001-01-2

MW:: 350.900
MF:: C₁₇H₁₉ClN₂O₂S

IUPAC name:: (3R,3aR,6aS)-3-[(5-chloropyridin-3-yl)oxymethyl]-5-(thiophen...

Create Date:: 2018-07-20

CID:: 134690527

Summary Similar Compounds Same Parent, Connectivity

Select item 1346903188.

an image of a chemical structure CID 134690318

BRD-A47266339-001-01-9

MW:: 342.500
MF:: C₁₉H₂₂N₂O₂S

IUPAC name:: 1-[4-(cyclopropylmethyl)-2-phenyl-5,6-dihydropyrrolo[3,2-d][...

Create Date:: 2018-07-20

CID:: 134690318

Summary Similar Compounds Same Parent, Connectivity

Select item 1346901879.

an image of a chemical structure CID 134690187

BRD-K75080785-001-01-6

MW:: 336.400
MF:: C₂₁H₂₄N₂O₂

IUPAC name:: (1S,5S,6S)-3-[(2-methylphenyl)methyl]-N-phenyl-8-oxa-3-azabi...

Create Date:: 2018-07-20

CID:: 134690187

Summary Similar Compounds Same Parent, Connectivity

Select item 13469000810.

an image of a chemical structure CID 134690008

BRD-A35217605-001-01-3

MW:: 426.600
MF:: C₂₃H₃₀N₄O₂S

IUPAC name:: (2R,6R)-4-[(2-methylphenyl)methyl]-12-(3-methylpiperidin-1-y...

Create Date:: 2018-07-20

CID:: 134690008

Summary Similar Compounds Same Parent, Connectivity

Select item 13407372311.

an image of a chemical structure CID 134073723

BRD-A70097927-001-01-6

MW:: 287.360
MF:: C₁₆H₂₁N₃O₂

IUPAC name:: 1-[(3-cyanophenyl)methyl]-4-(dimethylamino)piperidine-2-carb...

Create Date:: 2018-05-25

CID:: 134073723

Summary Similar Compounds Same Parent, Connectivity

Select item 13165582412.

an image of a chemical structure CID 131655824

BRD-A57826888-001-01-2

MW:: 368.500
MF:: C₂₂H₂₈N₂OS

IUPAC name:: N-[(5-methylthiophen-2-yl)methyl]-1'-prop-2-enylspiro[3,4-di...

Create Date:: 2017-10-20

CID:: 131655824

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13165512113.

an image of a chemical structure CID 131655121

BRD-A49619131-001-01-7

MW:: 387.500
MF:: C₂₄H₂₅N₃O₂

IUPAC name:: 1'-[(3-methoxyphenyl)methyl]-2-phenylspiro[5,7-dihydropyrano...

Create Date:: 2017-10-20

CID:: 131655121

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13164839514.

an image of a chemical structure CID 131648395

BRD-A44610970-001-01-5

MW:: 375.400
MF:: C₂₀H₂₀F₃N₃O

IUPAC name:: N-phenyl-6-[[4-(trifluoromethyl)phenyl]methyl]-3,6-diazabicy...

Create Date:: 2017-10-20

CID:: 131648395

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13164828815.

an image of a chemical structure CID 131648288

BRD-A92383506-001-01-3

MW:: 417.600
MF:: C₂₂H₃₁N₃O₃S

IUPAC name:: 4-[[2-(4-ethylphenyl)sulfonyl-2,9-diazaspiro[4.5]decan-9-yl]...

Create Date:: 2017-10-20

CID:: 131648288

Summary Similar Compounds Same Parent, Connectivity

Select item 13164378616.

an image of a chemical structure CID 131643786

BRD-A38537208-001-01-2

MW:: 391.900
MF:: C₂₃H₂₂ClN₃O

IUPAC name:: 1'-[(3-chlorophenyl)methyl]-2-phenylspiro[5,7-dihydropyrano[...

Create Date:: 2017-10-20

CID:: 131643786

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13164259517.

an image of a chemical structure CID 131642595

BRD-A04789482-001-01-6

MW:: 330.500
MF:: C₁₉H₂₃FN₂S

IUPAC name:: 2-[(3-fluorophenyl)methyl]-5-[(5-methylthiophen-2-yl)methyl]...

Create Date:: 2017-10-20

CID:: 131642595

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13164228718.

an image of a chemical structure CID 131642287

BRD-A73110096-001-01-9

MW:: 331.500
MF:: C₁₉H₂₉N₃O₂

IUPAC name:: 1-[(9-benzyl-2-oxa-9-azaspiro[5.5]undecan-3-yl)methyl]-3-met...

Create Date:: 2017-10-20

CID:: 131642287

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13164046319.

an image of a chemical structure CID 131640463

BRD-A50893771-001-01-9

MW:: 348.400
MF:: C₁₈H₂₁FN₂O₂S

IUPAC name:: 3-(3-fluoropyridin-2-yl)oxy-8-(thiophen-3-ylmethyl)-1-oxa-8-...

Create Date:: 2017-10-20

CID:: 131640463

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 13163977120.

an image of a chemical structure CID 131639771

BRD-A24295110-001-01-0

MW:: 343.400
MF:: C₁₉H₂₂FN₃O₂

IUPAC name:: [1-(cyclopropylmethyl)-7-(methoxymethyl)-6,7-dihydro-4H-pyra...

Create Date:: 2017-10-20

CID:: 131639771

Summary Similar Compounds Same Parent, Connectivity

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Chemical Properties

Rule of 5 (659)
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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Protein 3D Structures (19)
Compounds bound to proteins in atructure biology experiments

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Compounds involved in biological pathways

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