General Information of the Compound
Compound ID
CP0421436
Compound Name
6-naphthalen-1-yl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyridazin-3-amine
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Structure
Formula
C23H28N4
Molecular Weight
360.505
Canonical SMILES
CC1(C)CC(CC(C)(C)N1)Nc1ccc(nn1)-c1cccc2ccccc12
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InChI
InChI=1S/C23H28N4/c1-22(2)14-17(15-23(3,4)27-22)24-21-13-12-20(25-26-21)19-11-7-9-16-8-5-6-10-18(16)19/h5-13,17,27H,14-15H2,1-4H3,(H,24,26)
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InChIKey
APMDQRMRXAZMDY-UHFFFAOYSA-N
Physicochemical Property
logP
5.0179
Rotatable Bonds
3
Heavy Atom Count
27
Polar Areas
49.84
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Complexity
27

"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: 145981598
ChEMBL ID
CHEMBL4277857
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: PT00897, Potassium voltage-gated channel subfamily H member 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 > 30000 nM
   TI
   LI
   LO
   TS