Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L8KC9O
|
|||
| Ligand Name |
7-anilino-3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-[1-[(E)-4-(dimethylamino)but-2-enoyl]piperidin-4-yl]-4H-pyrimido[4,5-d]pyrimidin-2-one
|
|||
| Synonyms |
CHEMBL4096041; 3-(2,6-Dichloro-3,5-Dimethoxyphenyl)-1-{1-[4-(Dimethylamino)but-2-Enoyl]piperidin-4-Yl}-7-(Phenylamino)-3,4-Dihydropyrimido[4,5-D]pyrimidin-2(1h)-One; SCHEMBL20487069; BDBM50260185
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C31H35Cl2N7O4
|
|||
| Canonical SMILES |
CN(C)CC=CC(=O)N1CCC(CC1)N2C3=NC(=NC=C3CN(C2=O)C4=C(C(=CC(=C4Cl)OC)OC)Cl)NC5=CC=CC=C5
|
|||
| InChI |
1S/C31H35Cl2N7O4/c1-37(2)14-8-11-25(41)38-15-12-22(13-16-38)40-29-20(18-34-30(36-29)35-21-9-6-5-7-10-21)19-39(31(40)42)28-26(32)23(43-3)17-24(44-4)27(28)33/h5-11,17-18,22H,12-16,19H2,1-4H3,(H,34,35,36)/b11-8+
|
|||
| InChIKey |
YHIGPAIFBVOPKV-DHZHZOJOSA-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.