General Information of the Compound
Compound ID
CP0417754
Compound Name
N,4-diphenyl-1,3-thiazol-2-amine
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Structure
Formula
C15H12N2S
Molecular Weight
252.342
Canonical SMILES
N(c1nc(cs1)-c1ccccc1)c1ccccc1
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InChI
InChI=1S/C15H12N2S/c1-3-7-12(8-4-1)14-11-18-15(17-14)16-13-9-5-2-6-10-13/h1-11H,(H,16,17)
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InChIKey
FAXWKQAPUYLLPC-UHFFFAOYSA-N
Physicochemical Property
logP
4.5537
Rotatable Bonds
3
Heavy Atom Count
18
Polar Areas
24.92
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
18

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 954216
SID: 99243002
ChEMBL ID
CHEMBL510166
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT04088, Small conductance calcium-activated potassium channel protein 3
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 > 30000 nM
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