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Compound Detail

CHEMBL1206166

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CC(C)n1c(C#N)c(-c2ccccn2)c(-c2ccc(F)cc2)c1CC[C@@H](O)C[C@@H](O)CC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1206166
Phase Preclinical
Structure Type MOL
InChI Key SROAHSZUIFXTRD-WOJBJXKFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

465.5
MW (Da)
4.33
ALogP
6
HBA
3
HBD
119.4
PSA (Ų)
0.41
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H28FN3O4
MW 465.53
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.37

Data from ChEMBL 36 via Core Engine