General Information of the Compound
Compound ID
CP0434693
Compound Name
(1H-Benzoimidazol-2-yl)indan-2-ylamine
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Structure
Formula
C16H15N3
Molecular Weight
249.317
Canonical SMILES
C1C(Cc2ccccc12)Nc1nc2ccccc2[nH]1
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InChI
InChI=1S/C16H15N3/c1-2-6-12-10-13(9-11(12)5-1)17-16-18-14-7-3-4-8-15(14)19-16/h1-8,13H,9-10H2,(H2,17,18,19)
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InChIKey
RHAYGDUMTNFDNJ-UHFFFAOYSA-N
Physicochemical Property
logP
3.1422
Rotatable Bonds
2
Heavy Atom Count
19
Polar Areas
40.71
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
19

"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: 11658857
SID: 16762452
ChEMBL ID
CHEMBL453486
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: PT02468, 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
Kd = 1700 nM
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