Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C19H29N5O3 |
| Molecular Weight | 375.4653 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1N=C(C=CC1=O)N2CCC(CC2)OC(=O)N3CCN(CC3)C4CCC4
InChI
InChIKey=BVUJMFFRMZRNAT-UHFFFAOYSA-N
InChI=1S/C19H29N5O3/c1-21-18(25)6-5-17(20-21)23-9-7-16(8-10-23)27-19(26)24-13-11-22(12-14-24)15-3-2-4-15/h5-6,15-16H,2-4,7-14H2,1H3
| Molecular Formula | C19H29N5O3 |
| Molecular Weight | 375.4653 |
| 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 13:30:19 UTC 2023
by
admin
on
Sat Dec 16 13:30:19 UTC 2023
|
| Record UNII |
UM4TJY3PCY
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Common Name | English |
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UM4TJY3PCY
Created by
admin on Sat Dec 16 13:30:19 UTC 2023 , Edited by admin on Sat Dec 16 13:30:19 UTC 2023
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72948400
Created by
admin on Sat Dec 16 13:30:19 UTC 2023 , Edited by admin on Sat Dec 16 13:30:19 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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TRANSPORTER -> NON-SUBSTRATE |
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TARGET->INVERSE AGONIST |
BINDING
Ki
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TARGET->INVERSE AGONIST |
cAMP functional assay
Ki
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OFF TARGET->NON-INHIBITOR |
6% inhibition at 10 micromolar
IC50
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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| Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
|---|---|---|---|---|---|---|
| BRAIN/PLASMA RATIO | PHARMACOKINETIC |
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Species BIOLOGICAL |
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