Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C29H30N8O5 |
| Molecular Weight | 570.5991 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCN1C(=NC2=C1C=C(OC3=CC=CC(NC(=O)C4=CC=C(OCCN5CCOCC5)C=C4)=C3)N=C2)C6=NON=C6N
InChI
InChIKey=YOVNFNXUCOWYSG-UHFFFAOYSA-N
InChI=1S/C29H30N8O5/c1-2-37-24-17-25(31-18-23(24)33-28(37)26-27(30)35-42-34-26)41-22-5-3-4-20(16-22)32-29(38)19-6-8-21(9-7-19)40-15-12-36-10-13-39-14-11-36/h3-9,16-18H,2,10-15H2,1H3,(H2,30,35)(H,32,38)
| Molecular Formula | C29H30N8O5 |
| Molecular Weight | 570.5991 |
| 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: Q13464 Gene ID: 6093.0 Gene Symbol: ROCK1 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/17018693 |
1.6 nM [IC50] | ||
Target ID: O75116 Gene ID: 9475.0 Gene Symbol: ROCK2 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/17018693 |
4.0 nM [IC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 12:06:22 GMT 2025
by
admin
on
Wed Apr 02 12:06:22 GMT 2025
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| Record UNII |
F89KMM7TE2
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| Record Status |
Validated (UNII)
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| Record Version |
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850664-21-0
Created by
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8037
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16095342
Created by
admin on Wed Apr 02 12:06:22 GMT 2025 , Edited by admin on Wed Apr 02 12:06:22 GMT 2025
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F89KMM7TE2
Created by
admin on Wed Apr 02 12:06:22 GMT 2025 , Edited by admin on Wed Apr 02 12:06:22 GMT 2025
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