Details
Stereochemistry | ACHIRAL |
Molecular Formula | C25H27N3O2S |
Molecular Weight | 433.566 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O=C1NC2=C(C=C1)C=CC(OCCCCN3CCN(CC3)C4=CC=CC5=C4C=CS5)=C2
InChI
InChIKey=ZKIAIYBUSXZPLP-UHFFFAOYSA-N
InChI=1S/C25H27N3O2S/c29-25-9-7-19-6-8-20(18-22(19)26-25)30-16-2-1-11-27-12-14-28(15-13-27)23-4-3-5-24-21(23)10-17-31-24/h3-10,17-18H,1-2,11-16H2,(H,26,29)
Molecular Formula | C25H27N3O2S |
Molecular Weight | 433.566 |
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 01:28:09 UTC 2023
by
admin
on
Sat Dec 16 01:28:09 UTC 2023
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Record UNII |
2J3YBM1K8C
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Record Status |
Validated (UNII)
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Record Version |
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-
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Official Name | English | ||
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Common Name | English | ||
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Code | English | ||
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Common Name | English | ||
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Brand Name | English | ||
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Common Name | English |
Classification Tree | Code System | Code | ||
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WHO-ATC |
N05AX16
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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NDF-RT |
N0000175430
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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Code System | Code | Type | Description | ||
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2J3YBM1K8C
Created by
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913611-97-9
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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1658314
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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PRIMARY | RxNorm | ||
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100000141399
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C166575
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2J3YBM1K8C
Created by
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5014
Created by
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CHEMBL2105760
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DTXSID40238527
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admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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7672
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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m11883
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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11978813
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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Brexpiprazole
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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BREXPIPRAZOLE
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YY-38
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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9552
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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DB09128
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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SUB91646
Created by
admin on Sat Dec 16 01:28:09 UTC 2023 , Edited by admin on Sat Dec 16 01:28:09 UTC 2023
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Related Record | Type | Details | ||
---|---|---|---|---|
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METABOLIC ENZYME -> SUBSTRATE | |||
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METABOLIC ENZYME -> NON-SUBSTRATE | |||
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METABOLIC ENZYME -> NON-SUBSTRATE | |||
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TARGET->PARTIAL AGONIST |
BINDING
Ki
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METABOLIC ENZYME -> NON-SUBSTRATE | |||
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TARGET->PARTIAL AGONIST |
Ki
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METABOLIC ENZYME -> NON-SUBSTRATE | |||
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TARGET -> INHIBITOR |
Ki
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BINDER->LIGAND |
BINDING
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TARGET -> INHIBITOR |
Ki
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Related Record | Type | Details | ||
---|---|---|---|---|
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METABOLITE LESS ACTIVE -> PARENT |
MAJOR
PLASMA
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||
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METABOLITE LESS ACTIVE -> PARENT | |||
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METABOLITE -> PARENT | |||
|
METABOLITE -> PARENT | |||
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METABOLITE LESS ACTIVE -> PARENT |
MAJOR
PLASMA
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METABOLITE -> PARENT | |||
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METABOLITE -> PARENT | |||
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METABOLITE -> PARENT |
MINOR
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METABOLITE -> PARENT | |||
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METABOLITE LESS ACTIVE -> PARENT | |||
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METABOLITE LESS ACTIVE -> PARENT |
Related Record | Type | Details | ||
---|---|---|---|---|
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ACTIVE MOIETY |
Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Biological Half-life | PHARMACOKINETIC |
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Volume of Distribution | PHARMACOKINETIC |
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