Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L8QP3E
|
|||
| Ligand Name |
(11r)-11-[(1-Aminoisoquinolin-6-Yl)amino]-16-(Cyclopropylsulfonyl)-13-Methyl-2,13-Diazatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-Hexaene-3,12-Dione
|
|||
| Synonyms |
CHEMBL3905354; (11r)-11-[(1-Aminoisoquinolin-6-Yl)amino]-16-(Cyclopropylsulfonyl)-13-Methyl-2,13-Diazatricyclo[13.3.1.1~6,10~]icosa-1(19),6(20),7,9,15,17-Hexaene-3,12-Dione; SCHEMBL16307023; BDBM50205817; 7KR
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C31H31N5O4S
|
|||
| Canonical SMILES |
CN1CC2=C(C=CC(=C2)NC(=O)CCC3=CC(=CC=C3)C(C1=O)NC4=CC5=C(C=C4)C(=NC=C5)N)S(=O)(=O)C6CC6
|
|||
| InChI |
1S/C31H31N5O4S/c1-36-18-22-17-23(7-11-27(22)41(39,40)25-8-9-25)34-28(37)12-5-19-3-2-4-21(15-19)29(31(36)38)35-24-6-10-26-20(16-24)13-14-33-30(26)32/h2-4,6-7,10-11,13-17,25,29,35H,5,8-9,12,18H2,1H3,(H2,32,33)(H,34,37)/t29-/m1/s1
|
|||
| InChIKey |
LGIRRDHRFMYVGC-GDLZYMKVSA-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.