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Compound Detail

CHEMBL4594825

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CCCCCCCCCCSSCCOP(=O)(O)CO[C@H](C)Cn1cnc2c(N)ncnc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4594825
Phase Preclinical
Structure Type MOL
InChI Key BWVJZLYBCVLZBL-GOSISDBHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

519.7
MW (Da)
5.50
ALogP
10
HBA
2
HBD
125.4
PSA (Ų)
0.14
QED
2
Ro5 Violations
19
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H38N5O4PS2
MW 519.67
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness 0.03

Data from ChEMBL 36 via Core Engine