Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C28H29N7O |
| Molecular Weight | 479.5762 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(NC(=O)C2=CC=C(CN3CCNCC3)C=C2)C=C1NC4=NC=CC(=N4)C5=CC=CN=C5
InChI
InChIKey=BQQYXPHRXIZMDM-UHFFFAOYSA-N
InChI=1S/C28H29N7O/c1-20-4-9-24(17-26(20)34-28-31-12-10-25(33-28)23-3-2-11-30-18-23)32-27(36)22-7-5-21(6-8-22)19-35-15-13-29-14-16-35/h2-12,17-18,29H,13-16,19H2,1H3,(H,32,36)(H,31,33,34)
| Molecular Formula | C28H29N7O |
| Molecular Weight | 479.5762 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
CNS Activity
Originator
Approval Year
Sample Use Guides
The effects of CGP74588 on BCR-ABL1 autophosphorylation and on BCR-ABL1-dependent cell viability were determined in murine haematopoietic Ba/F3 cells transfected to express human BCR-ABL1, using a capture enzyme-linked immunosorbant (ELISA) and a luminescence ATP-detection assay. CGP74588 shows potent inhibition of BCR-ABL in nanomolar range.
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Oct 22 13:28:25 UTC 2019
by
admin
on
Tue Oct 22 13:28:25 UTC 2019
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| Record UNII |
6GOH0N63QD
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| Record Status |
Validated (UNII)
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| Record Version |
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404844-02-6
Created by
admin on Tue Oct 22 13:28:25 UTC 2019 , Edited by admin on Tue Oct 22 13:28:25 UTC 2019
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404844-03-7
Created by
admin on Tue Oct 22 13:28:25 UTC 2019 , Edited by admin on Tue Oct 22 13:28:25 UTC 2019
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9869737
Created by
admin on Tue Oct 22 13:28:25 UTC 2019 , Edited by admin on Tue Oct 22 13:28:25 UTC 2019
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404844-02-6
Created by
admin on Tue Oct 22 13:28:25 UTC 2019 , Edited by admin on Tue Oct 22 13:28:25 UTC 2019
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PRIMARY |
| Related Record | Type | Details | ||
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BINDER->LIGAND |
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| Related Record | Type | Details | ||
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PARENT -> METABOLITE ACTIVE |
AUTOINHIBITION
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