General Information of the Compound
| Compound ID |
CP0851157
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
trans-[3-(2-Aminomethylcyclopropyl)phenyl]benzylamine Hydrochloride
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C17H21ClN2
|
||||||||||||||||||
| Molecular Weight |
288.822
|
||||||||||||||||||
| Canonical SMILES |
Cl.NC[C@H]1C[C@@H]1c1cccc(NCc2ccccc2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C17H20N2.ClH/c18-11-15-10-17(15)14-7-4-8-16(9-14)19-12-13-5-2-1-3-6-13;/h1-9,15,17,19H,10-12,18H2;1H/t15-,17-;/m1./s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
XBNFKLZGAOOWOB-SSPJITILSA-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