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Compound Detail

CHEMBL4116260

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NCc1cc(Oc2cccc(C(=O)NC[C@@H](O)CO)c2)nc(C(F)(F)F)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4116260
Phase Preclinical
Structure Type MOL
InChI Key SONNQRNOTIAJDS-GFCCVEGCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

385.3
MW (Da)
1.43
ALogP
6
HBA
4
HBD
117.7
PSA (Ų)
0.57
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18F3N3O4
MW 385.34
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -1.07

Data from ChEMBL 36 via Core Engine