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Compound Detail

CHEMBL1183020

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CCCCCCCCCCNC[C@H](O[C@@H]1O[C@H](CN)[C@@H](O)[C@H]1O)[C@@H]1C[C@@H](O)[C@H](n2ccc(=O)[nH]c2=O)O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183020
Phase Preclinical
Structure Type MOL
InChI Key MBYDCXYZDTUARP-VXAIIWMZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

528.6
MW (Da)
-0.29
ALogP
11
HBA
6
HBD
181.3
PSA (Ų)
0.16
QED
3
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H44N4O8
MW 528.65
Aromatic Rings 1
Heavy Atoms 37
NP-Likeness 1.16

Data from ChEMBL 36 via Core Engine