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Compound Detail

CHEMBL1208012

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O=C1N[C@@H]2C(=C[C@H](O)[C@@H](O)[C@H]2O)c2cc3c(c(OP(=O)(O)OCc4ccccc4)c21)OCO3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208012
Phase Preclinical
Structure Type MOL
InChI Key NOPFSDNAHLWEES-LIRZEXBASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

477.4
MW (Da)
0.70
ALogP
9
HBA
5
HBD
164.0
PSA (Ų)
0.39
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H20NO10P
MW 477.36
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness 1.47

Data from ChEMBL 36 via Core Engine