Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L3TXG2
|
|||
| Ligand Name |
N-(Carboxymethyl)-3-Cyclohexyl-D-Alanyl-N-({6-[amino(Imino)methyl]pyridin-3-Yl}methyl)-N~2~-Methyl-L-Alaninamide
|
|||
| Synonyms |
CHEMBL208262; N-(Carboxymethyl)-3-Cyclohexyl-D-Alanyl-N-({6-[amino(Imino)methyl]pyridin-3-Yl}methyl)-N~2~-Methyl-L-Alaninamide; 2a2x; BDBM50182207; NA9; Q27463717; [(R)-1-({(S)-1-[(6-carbamimidoyl-pyridin-3-ylmethyl)-carbamoyl]-ethyl}-methyl-carbamoyl)-2-cyclohexyl-ethylamino]-acetic acid
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C22H34N6O4
|
|||
| Canonical SMILES |
CC(C(=O)NCC1=CN=C(C=C1)C(=N)N)N(C)C(=O)C(CC2CCCCC2)NCC(=O)O
|
|||
| InChI |
1S/C22H34N6O4/c1-14(21(31)27-12-16-8-9-17(20(23)24)25-11-16)28(2)22(32)18(26-13-19(29)30)10-15-6-4-3-5-7-15/h8-9,11,14-15,18,26H,3-7,10,12-13H2,1-2H3,(H3,23,24)(H,27,31)(H,29,30)/t14-,18+/m0/s1
|
|||
| InChIKey |
XVBUQSSETBYPJB-KBXCAEBGSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.