PubChem Compound Links for Structure (Select 90912) - PubChem Compound - NCBI

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Links from Structure

Items: 2

Select item 167599971.

an image of a chemical structure CID 16759997

4-[(2S)-3-(tert-butylamino)-2-hydroxypropoxy]-1H-indole-2-carbonitrile; Biomol-NT_000119; BPBio1_000309 ...

MW:: 287.360
MF:: C₁₆H₂₁N₃O₂

IUPAC name:: 4-[(2S)-3-(tert-butylamino)-2-hydroxypropoxy]-1H-indole-2-ca...

Create Date:: 2007-11-09

CID:: 16759997

Summary Similar Compounds Same Parent, Connectivity Mixture/Component Compounds

Select item 6569092.

an image of a chemical structure CID 656909

85618-21-9; n-octyl-beta-D-thioglucopyranoside; Octyl thioglucoside ...

MW:: 308.440
MF:: C₁₄H₂₈O₅S

IUPAC name:: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-octylsulfanyloxane-3,4,...

Create Date:: 2005-06-24

CID:: 656909

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

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Chemical Properties

Rule of 5 (2)
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, Tested (1)
Compounds identified as tested in screening experiments

Protein 3D Structures (2)
Compounds bound to proteins in atructure biology experiments

BioMedical Annotation

Pharmacological Actions (1)
Therapeutic use and National Library of Medicine (NLM) compound classifications

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