'1029 [512086]
'1029
| SMILES | CCCCCCN(CC(=O)OC)C(=O)c1ccc(CC)c(S(=O)(=O)N2CCOCC2)c1 |
| InChIKey | TUOAUMHGAZXZHS-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 11 |
| Log P | 2.465 |
| Molecular weight (Da) | 454.2 |
| Stereochemistry info | unspecified |
Database connections
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| Structure pdb | 12JA |
No bioactivity data available.
'1029
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
Database connections
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| Structure pdb | 12JA |