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Compound Detail

CHEMBL1206165

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CC(C)n1c(CC[C@@H](O)C[C@@H](O)CC(=O)O)c(-c2ccc(F)cc2)c(-c2ccccn2)c1C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1206165
Phase Preclinical
Structure Type MOL
InChI Key WLAYEDHSMAATOA-RTBURBONSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

483.5
MW (Da)
3.56
ALogP
6
HBA
4
HBD
138.7
PSA (Ų)
0.33
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H30FN3O5
MW 483.54
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.30

Data from ChEMBL 36 via Core Engine