General Information of the Compound
Compound ID
CP0004824
Compound Name
N'-benzylbenzenecarboximidamide
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Structure
Formula
C14H14N2
Molecular Weight
210.28
Canonical SMILES
NC(=NCc1ccccc1)c1ccccc1
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InChI
InChI=1S/C14H14N2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2,(H2,15,16)
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InChIKey
QZARWWZWTPDHPY-UHFFFAOYSA-N
Physicochemical Property
logP
2.5921
Rotatable Bonds
3
Heavy Atom Count
16
Polar Areas
38.38
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
16

"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: 200369
SID: 15738053
ChEMBL ID
CHEMBL350615
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: PT02751, Glutamate receptor ionotropic, NMDA 2B
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000309 NCTC clone 929 Mus musculus (Mouse)  1
1
Ki > 15000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 10000 nM