Details
| Stereochemistry | UNKNOWN |
| Molecular Formula | C25H27N3O3S |
| Molecular Weight | 449.565 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[O-][S+]1C=CC2=C1C=CC=C2N3CCN(CCCCOC4=CC5=C(C=CC(=O)N5)C=C4)CC3
InChI
InChIKey=VJYXYAVCCLPIPM-UHFFFAOYSA-N
InChI=1S/C25H27N3O3S/c29-25-9-7-19-6-8-20(18-22(19)26-25)31-16-2-1-11-27-12-14-28(15-13-27)23-4-3-5-24-21(23)10-17-32(24)30/h3-10,17-18H,1-2,11-16H2,(H,26,29)
| Molecular Formula | C25H27N3O3S |
| Molecular Weight | 449.565 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:11:39 UTC 2023
by
admin
on
Sat Dec 16 10:11:39 UTC 2023
|
| Record UNII |
N22UPQ09R0
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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44256485
Created by
admin on Sat Dec 16 10:11:40 UTC 2023 , Edited by admin on Sat Dec 16 10:11:40 UTC 2023
|
PRIMARY | |||
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N22UPQ09R0
Created by
admin on Sat Dec 16 10:11:40 UTC 2023 , Edited by admin on Sat Dec 16 10:11:40 UTC 2023
|
PRIMARY | |||
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1191900-51-2
Created by
admin on Sat Dec 16 10:11:40 UTC 2023 , Edited by admin on Sat Dec 16 10:11:40 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
BINDER->LIGAND |
BINDING
|
||
|
TRANSPORTER -> INHIBITOR |
INHIBITOR
IC50
|
||
|
INHIBITOR -> TRANSPORTER |
IC50
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE LESS ACTIVE |
PLASMA
|
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PARENT -> METABOLITE LESS ACTIVE |
PLASMA
|
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PARENT -> METABOLITE LESS ACTIVE |
PLASMA
|
||
|
PARENT -> METABOLITE LESS ACTIVE |
PLASMA
|
