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Items: 1 to 20 of 173

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Select item 1355658881.

an image of a chemical structure CID 135565888

2JIZ556BA3; Cylindrospermopsine; (2aS,3R,4S,5aS,7R)-7-[(R)-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)(hydroxy)methyl]-3-methyl-2a,3,4,5,5a,6,7,8-octahydro-2H-1,8,8b-triazaacenaphthylen-4-yl hydrogen sulfate ...

MW:: 415.400
MF:: C₁₅H₂₁N₅O₇S

IUPAC name:: [(4S,5R,6S,8S,10R)-10-[(R)-(2,4-dioxo-1H-pyrimidin-6-yl)-hyd...

Create Date:: 2019-01-15

CID:: 135565888

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1355656352.

an image of a chemical structure CID 135565635

PP242; 1092351-67-1; TORKinib ...

MW:: 308.340
MF:: C₁₆H₁₆N₆O

IUPAC name:: 2-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-1H-in...

Create Date:: 2019-01-15

CID:: 135565635

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1353987453.

an image of a chemical structure CID 135398745

olanzapine; 132539-06-1; Zyprexa ...

MW:: 312.400
MF:: C₁₇H₂₀N₄S

IUPAC name:: 2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]be...

Create Date:: 2019-01-15

CID:: 135398745

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1353987374.

an image of a chemical structure CID 135398737

clozapine; 5786-21-0; Leponex ...

MW:: 326.800
MF:: C₁₈H₁₉ClN₄

IUPAC name:: 3-chloro-6-(4-methylpiperazin-1-yl)-11H-benzo[b][1,4]benzodi...

Create Date:: 2019-01-15

CID:: 135398737

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1226694015.

an image of a chemical structure CID 122669401

LLY-283; 2040291-27-6; (2R,3R,4S,5R)-2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-[(R)-hydroxy(phenyl)methyl]oxolane-3,4-diol ...

MW:: 342.350
MF:: C₁₇H₁₈N₄O₄

IUPAC name:: (2R,3R,4S,5R)-2-(4-aminopyrrolo[2,3-d]pyrimidin-7-yl)-5-[(R)...

Create Date:: 2016-12-08

CID:: 122669401

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 862786226.

an image of a chemical structure CID 86278622

Crocidolite; Crocidolite asbestos; Krokydolith ...

MW:: 855.380
MF:: Fe₂H₁₆Mg₃Na₂O₂₄Si₈⁺¹⁴

IUPAC name:: trimagnesium;disodium;dihydroxy(oxo)silane;iron(3+)

Create Date:: 2014-11-29

CID:: 86278622

Summary Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 783577677.

an image of a chemical structure CID 78357767

UNC0379; 1620401-82-2; 6,7-Dimethoxy-2-(pyrrolidin-1-yl)-N-(5-(pyrrolidin-1-yl)pentyl)quinazolin-4-amine ...

MW:: 413.600
MF:: C₂₃H₃₅N₅O₂

IUPAC name:: 6,7-dimethoxy-2-pyrrolidin-1-yl-N-(5-pyrrolidin-1-ylpentyl)q...

Create Date:: 2014-10-10

CID:: 78357767

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 716629608.

an image of a chemical structure CID 71662960

(1s,6r)-3-[2-(3,4-Dimethoxyphenoxy)ethyl]-10-[(2-Oxo-2,3-Dihydro-1,3-Benzothiazol-6-Yl)sulfonyl]-3,10-Diazabicyclo[4.3.1]decan-2-One; 4jfk; Q27461689 ...

MW:: 547.600
MF:: C₂₅H₂₉N₃O₇S₂

IUPAC name:: 6-[[(1S,6R)-3-[2-(3,4-dimethoxyphenoxy)ethyl]-2-oxo-3,10-dia...

Create Date:: 2013-08-26

CID:: 71662960

Summary Same Parent, Connectivity

Select item 468430579.

an image of a chemical structure CID 46843057

Afuresertib; 1047644-62-1; GSK-2110183 ...

MW:: 427.300
MF:: C₁₈H₁₇Cl₂FN₄OS

IUPAC name:: N-[(2S)-1-amino-3-(3-fluorophenyl)propan-2-yl]-5-chloro-4-(4...

Create Date:: 2010-08-16

CID:: 46843057

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 2501289810.

an image of a chemical structure CID 25012898

FGH10019; 1046045-61-7; FGH-10019 ...

MW:: 373.500
MF:: C₁₈H₁₉N₃O₂S₂

IUPAC name:: N-[4-[2-(2-propylpyridin-4-yl)-1,3-thiazol-4-yl]phenyl]metha...

Create Date:: 2008-11-03

CID:: 25012898

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 2497854411.

an image of a chemical structure CID 24978544

PCI 5002; bis[1-(hydroxy-kO)-5-{[2-(2-methoxyethoxy)ethoxy]methyl}-2-(sulfanyl-kS)pyridiniumato(2-)]zinc

MW:: 584.000
MF:: C₂₂H₃₄N₂O₈S₂Zn

IUPAC name:: 1-hydroxy-5-[2-(2-methoxyethoxy)ethoxymethyl]pyridin-1-ium-2...

Create Date:: 2008-10-27

CID:: 24978544

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

Select item 2366163712.

an image of a chemical structure CID 23661637

947303-87-9; PF-429242; (R)-4-((Diethylamino)methyl)-N-(2-methoxyphenethyl)-N-(pyrrolidin-3-yl)benzamide ...

MW:: 409.600
MF:: C₂₅H₃₅N₃O₂

IUPAC name:: 4-(diethylaminomethyl)-N-[2-(2-methoxyphenyl)ethyl]-N-[(3R)-...

Create Date:: 2008-02-04

CID:: 23661637

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 2159389213.

an image of a chemical structure CID 21593892

Azaspiracid-1; azaspiracid; 214899-21-5

MW:: 842.100
MF:: C₄₇H₇₁NO₁₂

Create Date:: 2007-12-05

CID:: 21593892

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 2122628714.

an image of a chemical structure CID 21226287

3,4-bis(2-ethylhexyl)phthalate; A803832

MW:: 388.500
MF:: C₂₄H₃₆O₄^-2

IUPAC name:: 3,4-bis(2-ethylhexyl)phthalate

Create Date:: 2007-12-05

CID:: 21226287

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 1675701915.

an image of a chemical structure CID 16757019

archazolid B; [(1S)-1-[4-[(2S,3S,4E,6E,8S,9S,10R,11E,13Z,15Z,17S,18S,19E,22E)-10,18-dihydroxy-8-methoxy-3,7,9,13,15,17,20-heptamethyl-24-oxo-1-oxacyclotetracosa-4,6,11,13,15,19,22-heptaen-2-yl]-1,3-thiazol-2-yl]-3-methylbutyl] N-methylcarbamate; 632335-03-6 ...

MW:: 725.000
MF:: C₄₁H₆₀N₂O₇S

IUPAC name:: [(1S)-1-[4-[(2S,3S,4E,6E,8S,9S,10R,11E,13Z,15Z,17S,18S,19E,2...

Create Date:: 2007-11-05

CID:: 16757019

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1668273016.

an image of a chemical structure CID 16682730

phenylmercuric acetate; 62-38-4; phenylmercury acetate ...

MW:: 336.740
MF:: C₈H₈HgO₂

IUPAC name:: acetyloxy(phenyl)mercury

Create Date:: 2007-08-23

CID:: 16682730

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1200451217.

an image of a chemical structure CID 12004512

gedunin; 2753-30-2; Gedunine ...

MW:: 482.600
MF:: C₂₈H₃₄O₇

IUPAC name:: [(1S,2R,4S,7S,8S,11R,12R,17R,19R)-7-(furan-3-yl)-1,8,12,16,1...

Create Date:: 2007-02-06

CID:: 12004512

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1162656018.

an image of a chemical structure CID 11626560

Crizotinib; 877399-52-5; PF-02341066 ...

MW:: 450.300
MF:: C₂₁H₂₂Cl₂FN₅O

IUPAC name:: 3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidi...

Create Date:: 2006-10-26

CID:: 11626560

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1152414419.

an image of a chemical structure CID 11524144

dorsomorphin; 866405-64-3; 6-(4-(2-(Piperidin-1-yl)ethoxy)phenyl)-3-(pyridin-4-yl)pyrazolo[1,5-a]pyrimidine ...

MW:: 399.500
MF:: C₂₄H₂₅N₅O

IUPAC name:: 6-[4-(2-piperidin-1-ylethoxy)phenyl]-3-pyridin-4-ylpyrazolo[...

Create Date:: 2006-10-26

CID:: 11524144

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 1123814720.

an image of a chemical structure CID 11238147

ICG-001; 847591-62-2; 780757-88-2 ...

MW:: 548.600
MF:: C₃₃H₃₂N₄O₄

IUPAC name:: (6S,9aS)-N-benzyl-6-[(4-hydroxyphenyl)methyl]-8-(naphthalen-...

Create Date:: 2006-10-26

CID:: 11238147

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

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Rule of 5 (96)
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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PubChem Compound Links for Gene (Select 3157) (173)
PubChem Compound
hydroxymethylglutaryl-CoA synthase, cytoplasmic isoform 2 [Homo sapiens]
hydroxymethylglutaryl-CoA synthase, cytoplasmic isoform 2 [Homo sapiens]
gi|1023300945|ref|NP_001311152.1|

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