Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H32N6O4 |
| Molecular Weight | 444.5273 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC(=O)NCCCN1N=C([C@@H](C)N(C2CC2)C(=O)[C@H]3CNCCO3)C4=CC=C(C)N=C14
InChI
InChIKey=GRTDDIZIUSADLD-CRAIPNDOSA-N
InChI=1S/C22H32N6O4/c1-14-5-8-17-19(26-27(20(17)25-14)11-4-9-24-22(30)31-3)15(2)28(16-6-7-16)21(29)18-13-23-10-12-32-18/h5,8,15-16,18,23H,4,6-7,9-13H2,1-3H3,(H,24,30)/t15-,18-/m1/s1
| Molecular Formula | C22H32N6O4 |
| Molecular Weight | 444.5273 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:00:22 GMT 2023
by
admin
on
Sat Dec 16 18:00:22 GMT 2023
|
| Record UNII |
C2M78A9V6Z
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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1399849-02-5
Created by
admin on Sat Dec 16 18:00:23 GMT 2023 , Edited by admin on Sat Dec 16 18:00:23 GMT 2023
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117877477
Created by
admin on Sat Dec 16 18:00:23 GMT 2023 , Edited by admin on Sat Dec 16 18:00:23 GMT 2023
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C2M78A9V6Z
Created by
admin on Sat Dec 16 18:00:23 GMT 2023 , Edited by admin on Sat Dec 16 18:00:23 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
TARGET -> INHIBITOR |
IC50
|
||
|
SALT/SOLVATE -> PARENT |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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