General Information of the Compound
| Compound ID |
CP0412968
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
[2-(naphthalen-2-ylamino)-2-oxoethyl] 4-(tetrazol-1-yl)benzoate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H15N5O3
|
||||||||||||||||||
| Molecular Weight |
373.372
|
||||||||||||||||||
| Canonical SMILES |
O=C(COC(=O)c1ccc(cc1)-n1cnnn1)Nc1ccc2ccccc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H15N5O3/c26-19(22-17-8-5-14-3-1-2-4-16(14)11-17)12-28-20(27)15-6-9-18(10-7-15)25-13-21-23-24-25/h1-11,13H,12H2,(H,22,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PWAKFKNEZJJBTN-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"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 | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
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: PT01390, BDNF/NT-3 growth factors receptor
Protein ID: PT00934, High affinity nerve growth factor receptor