compound 4c [PMID: 21571530] [2288]
compound 4c [PMID: 21571530]
| SMILES |
C[C@H](NC(=O)Cc1ccc(-c2ccc3cccnc3n2)cc1)c1ccc(-c2ccc(F)c(C(F)(F)F)c2)cc1 |
| InChIKey |
SSQLYMLUWZAJTK-IBGZPJMESA-N |
Chemical Properties
| Hydrogen bond acceptors |
3 |
| Hydrogen bond donors |
1 |
| Rotatable bonds |
6 |
| Log P |
7.542 |
| Molecular weight (Da) |
529.2 |
| Stereochemistry info |
full |
Bioactivities
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
Database |
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compound 4c [PMID: 21571530]
Drug properties
| Molecular type |
Small molecule |
| Physiological/Surrogate |
Surrogate |
| Approved drug |
No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0
Compound is not listed as a drug.