Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H19Cl2N3O4.2ClH |
| Molecular Weight | 545.243 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.N[C@@H](CC1=CC(Cl)=C(OCC2=CC(N)=CC3=C2OC(=N3)C4=CC=CC=C4)C(Cl)=C1)C(O)=O
InChI
InChIKey=MJSAOPNUSNNYQL-NTEVMMBTSA-N
InChI=1S/C23H19Cl2N3O4.2ClH/c24-16-6-12(8-18(27)23(29)30)7-17(25)21(16)31-11-14-9-15(26)10-19-20(14)32-22(28-19)13-4-2-1-3-5-13;;/h1-7,9-10,18H,8,11,26-27H2,(H,29,30);2*1H/t18-;;/m0../s1
| Molecular Formula | C23H19Cl2N3O4 |
| Molecular Weight | 472.321 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: Q01650 Gene ID: 8140.0 Gene Symbol: SLC7A5 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/24492461 |
AUC
| Value | Dose | Co-administered | Analyte | Population |
|---|---|---|---|---|
463.1 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/32198649/ |
12 mg/m² single, intravenous dose: 12 mg/m² route of administration: Intravenous experiment type: SINGLE co-administered: |
JPH-203 plasma | Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: UNKNOWN |
|
887.8 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/32198649/ |
25 mg/m² single, intravenous dose: 25 mg/m² route of administration: Intravenous experiment type: SINGLE co-administered: |
JPH-203 plasma | Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: UNKNOWN |
|
1460.5 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/32198649/ |
40 mg/m² single, intravenous dose: 40 mg/m² route of administration: Intravenous experiment type: SINGLE co-administered: |
JPH-203 plasma | Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: UNKNOWN |
|
2094.3 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/32198649/ |
60 mg/m² single, intravenous dose: 60 mg/m² route of administration: Intravenous experiment type: SINGLE co-administered: |
JPH-203 plasma | Homo sapiens population: UNHEALTHY age: ADULT sex: FEMALE / MALE food status: UNKNOWN |
|
3022.5 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/32198649/ |
85 mg/m² single, intravenous dose: 85 mg/m² route of administration: Intravenous experiment type: SINGLE co-administered: |
JPH-203 plasma | Homo sapiens population: UNHEALTHY age: ADULT sex: UNKNOWN food status: UNKNOWN |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 11:39:48 GMT 2025
by
admin
on
Wed Apr 02 11:39:48 GMT 2025
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| Record UNII |
ZJK9MX8G8Q
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| Record Status |
Validated (UNII)
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| Record Version |
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122553374
Created by
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Created by
admin on Wed Apr 02 11:39:48 GMT 2025 , Edited by admin on Wed Apr 02 11:39:48 GMT 2025
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ACTIVE MOIETY |
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