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Compound Detail

CHEMBL3930201

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CCC[C@@H]([C@@H](OC(C)=O)[C@@H](O)OCCCC(C)(O)C(=O)[C@H](C)[C@@H](OC(C)=O)[C@@H](C)COC(=O)[C@H](C)[C@H](CC)OCC[C@H](OC)[C@@H](OC(C)=O)[C@H](C)O)N(C)C

Basic Information

ChEMBL ID CHEMBL3930201
Phase Preclinical
Structure Type MOL
InChI Key LNUHZDUFPBKGJY-BOUSWSJVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

794.0
MW (Da)
2.98
ALogP
16
HBA
3
HBD
213.9
PSA (Ų)
0.04
QED
2
Ro5 Violations
29
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C39H71NO15
MW 793.99
Aromatic Rings 0
Heavy Atoms 55
NP-Likeness 0.59

Data from ChEMBL 36 via Core Engine