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Small molecule Experimental
AACT ChEMBL MeSH PubChem

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Chemistry

Mol. Mass

259.3

ALogP

-1.13

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CCCC(=O)O[C@H]1CN2CC[C@H](O)[C@@H]2[C@@H](O)[C@@H]1O
  • InChIKey: HTJGLYIJVSDQAE-VWNXEWBOSA-N
    InChI=1S/C12H21NO5/c1-2-3-9(15)18-8-6-13-5-4-7(14)10(13)12(17)11(8)16/h7-8,10-12,14,16-17H,2-6H2,1H3/t7-,8-,10+,11+,12+/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2110737   ChEMBL
celgosivir *

CHEMBL2105801   ChEMBL
celgosivir hydrochloride

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