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Compound Detail

CHEMBL4435196

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COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(/C(C)=N/OCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(N)=O)[C@@H](C)O)C(C)C)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1

Basic Information

ChEMBL ID CHEMBL4435196
Phase Preclinical
Structure Type MOL
InChI Key PISHOEROSSXOHF-DLXIHTBASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

1838.1
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C85H124N22O24
MW 1838.06

Literature References

PubMed DOI Target Context # Activities
31100648 10.1016/j.ejmech.2019.05.016 ADMET 1
31100648 10.1016/j.ejmech.2019.05.016 HT-29 1
31100648 10.1016/j.ejmech.2019.05.016 No relevant target 1

Data from ChEMBL 36 via Core Engine