Same Parent, Connectivity for PubChem Compound (Select 161569684) - PubChem Compound - NCBI

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Items: 2

Select item 1615696841.

an image of a chemical structure CID 161569684

MW:: 249.400
MF:: C₁₂H₁₃N₂S₂^-

IUPAC name:: 4-isothiocyanatobutylbenzene;isothiocyanate

Create Date:: 2021-12-03

CID:: 161569684

Summary Same Parent, Connectivity Mixture/Component Compounds

Select item 1248812.

an image of a chemical structure CID 124881

4-Phenylbutyl isothiocyanate; 61499-10-3; (4-isothiocyanatobutyl)benzene ...

MW:: 191.290
MF:: C₁₁H₁₃NS

IUPAC name:: 4-isothiocyanatobutylbenzene

Create Date:: 2005-07-19

CID:: 124881

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

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Chemical Properties

Rule of 5 (1)
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 (1)
Compounds identified as active in screening experiments

BioAssays, Tested (1)
Compounds identified as tested in screening experiments

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