TACROLIMUS ANHYDROUS [197695]
TACROLIMUS ANHYDROUS
| SMILES |
C=CC[C@@H]1/C=C(\C)C[C@H](C)C[C@H](OC)[C@H]2O[C@@](O)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@H](/C(C)=C/[C@@H]3CC[C@@H](O)[C@H](OC)C3)[C@H](C)[C@@H](O)CC1=O)[C@H](C)C[C@@H]2OC |
| InChIKey |
QJJXYPPXXYFBGM-LFZNUXCKSA-N |
Chemical Properties
| Hydrogen bond acceptors |
12 |
| Hydrogen bond donors |
3 |
| Rotatable bonds |
7 |
| Log P |
4.639 |
| Molecular weight (Da) |
803.5 |
| Stereochemistry info |
partial |
Bioactivities
|
| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
Database |
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| Receptor |
Activity |
Source |
| Protein |
Gene |
Species |
Family |
Class |
Type |
Min |
Avg |
Max |
Database |
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TACROLIMUS ANHYDROUS
Drug properties
| Molecular type |
Small molecule |
| Physiological/Surrogate |
Surrogate |
| Approved drug |
Yes |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0
Compound is not listed as a drug.