Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C30H30FN5O3 |
| Molecular Weight | 527.5893 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H](CN1CCOCC1)N2C(NC(N)=O)=NC3=C2C=CC(\C=C4/C5=CC=CC=C5COC6=CC(F)=CC=C46)=C3
InChI
InChIKey=YPCLDHGBEKZGEB-RUDKWAFVSA-N
InChI=1S/C30H30FN5O3/c1-19(17-35-10-12-38-13-11-35)36-27-9-6-20(15-26(27)33-30(36)34-29(32)37)14-25-23-5-3-2-4-21(23)18-39-28-16-22(31)7-8-24(25)28/h2-9,14-16,19H,10-13,17-18H2,1H3,(H3,32,33,34,37)/b25-14+/t19-/m1/s1
| Molecular Formula | C30H30FN5O3 |
| Molecular Weight | 527.5893 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 18:38:27 GMT 2025
by
admin
on
Mon Mar 31 18:38:27 GMT 2025
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| Record UNII |
6FHZ595FNM
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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6FHZ595FNM
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42636651
Created by
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1162264-07-4
Created by
admin on Mon Mar 31 18:38:27 GMT 2025 , Edited by admin on Mon Mar 31 18:38:27 GMT 2025
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DB15367
Created by
admin on Mon Mar 31 18:38:27 GMT 2025 , Edited by admin on Mon Mar 31 18:38:27 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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BINDER->LIGAND |
BINDING
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METABOLIC ENZYME -> SUBSTRATE | |||
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TARGET -> INHIBITOR |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
| Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
|---|---|---|---|---|---|---|
| Volume of Distribution | PHARMACOKINETIC |
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| log P | CHEMICAL |
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