compound 2b-1 [PMID: 12614873] [2178]
compound 2b-1 [PMID: 12614873]
| SMILES |
NC[C@@H]1CCCN(C(=O)c2ccc3c(c2)C(C(=O)NC2CCN(CC4=CCCCCCCC4)CC2)c2ccccc2O3)C1 |
| InChIKey |
AAPRNHKWNGDTOT-UXYOARKHSA-N |
Chemical Properties
| Hydrogen bond acceptors |
5 |
| Hydrogen bond donors |
2 |
| Rotatable bonds |
6 |
| Log P |
5.986 |
| Molecular weight (Da) |
584.4 |
| Stereochemistry info |
partial |
Bioactivities
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| Receptor |
Activity |
Source |
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Gene |
Species |
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Type |
Min |
Avg |
Max |
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
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compound 2b-1 [PMID: 12614873]
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.