Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L9RFP4
|
|||
| Ligand Name |
4-{[4-(1-Benzothiophen-4-Yloxy)-3-Chlorophenyl]amino}-N-(2-Hydroxyethyl)-8,9-Dihydro-7h-Pyrimido[4,5-B]azepine-6-Carboxamide
|
|||
| Synonyms |
CHEMBL2348417; 4-{[4-(1-Benzothiophen-4-Yloxy)-3-Chlorophenyl]amino}-N-(2-Hydroxyethyl)-8,9-Dihydro-7h-Pyrimido[4,5-B]azepine-6-Carboxamide; 3w33; BDBM50432373; Q27467170
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C25H22ClN5O3S
|
|||
| Canonical SMILES |
C1CNC2=C(C=C1C(=O)NCCO)C(=NC=N2)NC3=CC(=C(C=C3)OC4=C5C=CSC5=CC=C4)Cl
|
|||
| InChI |
1S/C25H22ClN5O3S/c26-19-13-16(4-5-21(19)34-20-2-1-3-22-17(20)7-11-35-22)31-24-18-12-15(25(33)28-9-10-32)6-8-27-23(18)29-14-30-24/h1-5,7,11-14,32H,6,8-10H2,(H,28,33)(H2,27,29,30,31)
|
|||
| InChIKey |
QHUDPFOODLMGQO-UHFFFAOYSA-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.