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Compound Detail

CHEMBL1208524

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CCCCCCSc1nc(N)c2ncn(C3O[C@H](COP(O)(O)=S)[C@@H](O)[C@H]3O)c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208524
Phase Preclinical
Structure Type MOL
InChI Key DPAGUSSBIWVODX-FJFSNTMWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

479.5
MW (Da)
0.93
ALogP
11
HBA
5
HBD
169.0
PSA (Ų)
0.14
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H26N5O6PS2
MW 479.52
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness 0.43

Data from ChEMBL 36 via Core Engine