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Compound Detail

CHEMBL2219599

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O=S(=O)(O)CCCCCCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

Basic Information

ChEMBL ID CHEMBL2219599
Phase Preclinical
Structure Type MOL
InChI Key KINMXHQJOCUMCC-WVSUBDOOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

487.6
MW (Da)
0.86
ALogP
11
HBA
5
HBD
179.9
PSA (Ų)
0.19
QED
1
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H33N5O7S
MW 487.58
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness 0.50

Data from ChEMBL 36 via Core Engine