Mixture/Component Compounds for PubChem Compound (Select 162044675) - PubChem Compound

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Items: 6

Select item 1576496881.

an image of a chemical structure CID 157649688

MW:: 426.400
MF:: C₂₁H₂₂N₄O₆

IUPAC name:: (2R)-2-[2-[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyri...

Create Date:: 2021-12-03

CID:: 157649688

Select item 1371412122.

an image of a chemical structure CID 137141212

SCHEMBL18540792

MW:: 441.400
MF:: C₂₁H₂₃N₅O₆

IUPAC name:: (2S)-2-[[3-[3-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimi...

Create Date:: 2019-01-25

CID:: 137141212

Select item 1358001093.

an image of a chemical structure CID 135800109

CHEMBL192632; SCHEMBL18540804; BDBM50171513 ...

MW:: 441.400
MF:: C₂₁H₂₃N₅O₆

IUPAC name:: (2S)-2-[[4-[3-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimi...

Create Date:: 2019-01-18

CID:: 135800109

Select item 1354001824.

an image of a chemical structure CID 135400182

Raltitrexed; Tomudex; 112887-68-0 ...

MW:: 458.500
MF:: C₂₁H₂₂N₄O₆S

IUPAC name:: (2S)-2-[[5-[methyl-[(2-methyl-4-oxo-3H-quinazolin-6-yl)methy...

Create Date:: 2019-01-15

CID:: 135400182

Select item 1269415.

an image of a chemical structure CID 126941

methotrexate; 59-05-2; Rheumatrex ...

MW:: 454.400
MF:: C₂₀H₂₂N₈O₅

IUPAC name:: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]ben...

Create Date:: 2005-06-24

CID:: 126941

Select item 2976.

an image of a chemical structure CID 297

02329_FLUKA; 0CB689EE-132E-4559-A597-C79A40192203; 14493-06-2 ...

MW:: 16.043
MF:: CH₄

IUPAC name:: methane

Create Date:: 2004-09-16

CID:: 297

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Chemical Properties

Rule of 5 (3)
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 (4)
Compounds identified as active in screening experiments

BioAssays, Tested (4)
Compounds identified as tested in screening experiments

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

BioMedical Annotation

Pharmacological Actions (2)
Therapeutic use and National Library of Medicine (NLM) compound classifications
BioSystems (2)
Compounds involved in biological pathways

Depositor Category