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PubChem Compound

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Select item 141011981.

an image of a chemical structure CID 14101198

FR900359; 107530-18-7; [(1R)-1-[(3S,6S,9S,12S,18R,21S,22R)-21-acetamido-18-benzyl-3-[(1R)-1-methoxyethyl]-4,9,10,12,16-pentamethyl-15-methylidene-2,5,8,11,14,17,20-heptaoxo-22-propan-2-yl-1,19-dioxa-4,7,10,13,16-pentazacyclodocos-6-yl]-2-methylpropyl] (2S,3R)-3-hydroxy-4-methyl-2-(propanoylamino)pentanoate ...

MW:: 1002.200
MF:: C₄₉H₇₅N₇O₁₅

IUPAC name:: [(1R)-1-[(3S,6S,9S,12S,18R,21S,22R)-21-acetamido-18-benzyl-3...

Create Date:: 2007-02-09

CID:: 14101198

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 112381472.

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 Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 98741913.

an image of a chemical structure CID 9874191

191089-59-5; K-7174; 1H-1,4-Diazepine, hexahydro-1,4-bis((4E)-5-(3,4,5-trimethoxyphenyl)-4-penten-1-yl)- ...

MW:: 568.700
MF:: C₃₃H₄₈N₂O₆

IUPAC name:: 1,4-bis[(E)-5-(3,4,5-trimethoxyphenyl)pent-4-enyl]-1,4-diaze...

Create Date:: 2006-10-25

CID:: 9874191

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

Select item 53715604.

an image of a chemical structure CID 5371560

DICROTOPHOS; Bidrin; Carbicron ...

MW:: 237.190
MF:: C₈H₁₆NO₅P

IUPAC name:: [(E)-4-(dimethylamino)-4-oxobut-2-en-2-yl] dimethyl phosphat...

Create Date:: 2005-03-27

CID:: 5371560

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

Select item 53603735.

an image of a chemical structure CID 5360373

bleomycin; Bleomicin; Bleocin ...

MW:: 1415.600
MF:: C₅₅H₈₄N₁₇O₂₁S₃⁺

IUPAC name:: 3-[[2-[2-[2-[[(2S,3R)-2-[[(2S,3S,4R)-4-[[(2S,3R)-2-[[6-amino...

Create Date:: 2005-06-24

CID:: 5360373

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

Select item 52843736.

an image of a chemical structure CID 5284373

cyclosporin A; cyclosporine; Ciclosporin ...

MW:: 1202.600
MF:: C₆₂H₁₁₁N₁₁O₁₂

IUPAC name:: (3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ethyl-33-[(E,1R,2R...

Create Date:: 2005-11-20

CID:: 5284373

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

Select item 12859417.

an image of a chemical structure CID 1285941

328968-36-1; C646; 4-[(4Z)-4-[[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid ...

MW:: 445.400
MF:: C₂₄H₁₉N₃O₆

IUPAC name:: 4-[(4Z)-4-[[5-(4,5-dimethyl-2-nitrophenyl)furan-2-yl]methyli...

Create Date:: 2005-07-10

CID:: 1285941

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

Select item 4463788.

an image of a chemical structure CID 446378

thapsigargin; 67526-95-8; MFCD00083511 ...

MW:: 650.800
MF:: C₃₄H₅₀O₁₂

IUPAC name:: [(3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-acetyloxy-4-butanoyloxy-3,3a...

Create Date:: 2005-06-01

CID:: 446378

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

Select item 4451549.

an image of a chemical structure CID 445154

resveratrol; 501-36-0; trans-resveratrol ...

MW:: 228.240
MF:: C₁₄H₁₂O₃

IUPAC name:: 5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol

Create Date:: 2005-03-25

CID:: 445154

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

Select item 44473210.

an image of a chemical structure CID 444732

trichostatin A; 58880-19-6; TSA ...

MW:: 302.370
MF:: C₁₇H₂₂N₂O₃

IUPAC name:: (2E,4E,6R)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethy...

Create Date:: 2005-06-01

CID:: 444732

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

Select item 44349511.

an image of a chemical structure CID 443495

SODIUM ARSENITE; 7784-46-5; Sodium metaarsenite ...

MW:: 129.910
MF:: AsNaO₂

IUPAC name:: sodium;oxoarsinite

Create Date:: 2005-03-27

CID:: 443495

Summary Mixture/Component Compounds PubMed (MeSH Keyword)

Select item 22040112.

an image of a chemical structure CID 220401

Demecolcine; colcemid; 477-30-5 ...

MW:: 371.400
MF:: C₂₁H₂₅NO₅

IUPAC name:: (7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-be...

Create Date:: 2005-03-26

CID:: 220401

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

Select item 10822313.

an image of a chemical structure CID 108223

2-deoxy-D-glucose; Deoxyglucose; 154-17-6 ...

MW:: 164.160
MF:: C₆H₁₂O₅

IUPAC name:: (3R,4S,5R)-3,4,5,6-tetrahydroxyhexanal

Create Date:: 2004-09-16

CID:: 108223

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

Select item 8214514.

an image of a chemical structure CID 82145

2-Bromohexadecanoic acid; 18263-25-7; 2-Bromopalmitic acid ...

MW:: 335.320
MF:: C₁₆H₃₁BrO₂

IUPAC name:: 2-bromohexadecanoic acid

Create Date:: 2005-03-26

CID:: 82145

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

Select item 7386415.

an image of a chemical structure CID 73864

Bisphenol AF; 1478-61-1; 2,2-Bis(4-hydroxyphenyl)hexafluoropropane ...

MW:: 336.230
MF:: C₁₅H₁₀F₆O₂

IUPAC name:: 4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phe...

Create Date:: 2005-03-26

CID:: 73864

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

Select item 7308716.

an image of a chemical structure CID 73087

3-Deazaneplanocin; 102052-95-9; 3-Deazaneplanocin A ...

MW:: 262.260
MF:: C₁₂H₁₄N₄O₃

IUPAC name:: (1S,2R,5R)-5-(4-aminoimidazo[4,5-c]pyridin-1-yl)-3-(hydroxym...

Create Date:: 2005-08-01

CID:: 73087

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

Select item 6616617.

an image of a chemical structure CID 66166

Bisphenol B; 2,2-Bis(4-hydroxyphenyl)butane; 77-40-7 ...

MW:: 242.310
MF:: C₁₆H₁₈O₂

IUPAC name:: 4-[2-(4-hydroxyphenyl)butan-2-yl]phenol

Create Date:: 2005-03-26

CID:: 66166

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

Select item 4132218.

an image of a chemical structure CID 41322

55097-80-8; BPDE; Benzo(a)pyrene diol epoxide ...

MW:: 302.300
MF:: C₂₀H₁₄O₃

IUPAC name:: 4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20)...

Create Date:: 2004-09-16

CID:: 41322

Summary Same Parent, Connectivity PubMed (MeSH Keyword)

Select item 3170319.

an image of a chemical structure CID 31703

doxorubicin; Adriamycin; 23214-92-8 ...

MW:: 543.500
MF:: C₂₇H₂₉NO₁₁

IUPAC name:: (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl...

Create Date:: 2005-06-24

CID:: 31703

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

Select item 2617720.

an image of a chemical structure CID 26177

13674-87-8; TDCPP; Tris(1,3-dichloro-2-propyl)phosphate ...

MW:: 430.900
MF:: C₉H₁₅Cl₆O₄P

IUPAC name:: tris(1,3-dichloropropan-2-yl) phosphate

Create Date:: 2005-03-27

CID:: 26177

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

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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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