General Information of the Compound
Compound ID
CP0385574
Compound Name
8-methyl-N-(4-methylphenethyl)tetrazolo[1,5-a]quinolin-4-amine
    Show/Hide
Structure
Formula
C18H18N6
Molecular Weight
318.384
Canonical SMILES
Cc1ccc(CCNc2nc3ccc(C)cc3n3nnnc23)cc1
    Show/Hide
InChI
InChI=1S/C18H18N6/c1-12-3-6-14(7-4-12)9-10-19-17-18-21-22-23-24(18)16-11-13(2)5-8-15(16)20-17/h3-8,11H,9-10H2,1-2H3,(H,19,20)
    Show/Hide
InChIKey
SYDVPDYVLXOVDG-UHFFFAOYSA-N
Physicochemical Property
logP
2.94394
Rotatable Bonds
4
Heavy Atom Count
24
Polar Areas
68
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
6
Complexity
24

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 20917185
ChEMBL ID
CHEMBL574994
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: PT00939, 5-hydroxytryptamine receptor 2C
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  1
1
IC50 > 10000 nM
   TI
   LI
   LO
   TS