Drug Information
| General Information | ||||||
|---|---|---|---|---|---|---|
| Drug ID |
DR01066
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| Drug Name |
DL-TBOA
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| Synonyms |
dl-threo-beta-benzyloxyaspartate
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| Drug Type |
Small molecular drug
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| Structure |
|
 |
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| 3D MOL | 2D MOL | |||||
| Formula |
C11H13NO5
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| Canonical SMILES |
C1=CC=C(C=C1)COC(C(C(=O)O)N)C(=O)O
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| InChI |
InChI=1S/C11H13NO5/c12-8(10(13)14)9(11(15)16)17-6-7-4-2-1-3-5-7/h1-5,8-9H,6,12H2,(H,13,14)(H,15,16)/t8-,9-/m0/s1
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| InChIKey |
BYOBCYXURWDEDS-IUCAKERBSA-N
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| Pharmaceutical Properties | Molecular Weight | 239.22 | Topological Polar Surface Area | 110 | ||
| Heavy Atom Count | 17 | Rotatable Bond Count | 6 | |||
| Hydrogen Bond Donor Count | 3 | Hydrogen Bond Acceptor Count | 6 | |||
| XLogP |
-2.4
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| PubChem CID | ||||||
| PubChem SID | ||||||
| TTD Drug ID | ||||||
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