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Compound Detail

CHEMBL1206172

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CCn1c(CC[C@@H](O)C[C@@H](O)CC(=O)O)c(-c2ccc(F)cc2)c(C)c1C(=O)NCc1ccc(C(=O)OC)cc1

Basic Information

ChEMBL ID CHEMBL1206172
Phase Preclinical
Structure Type MOL
InChI Key PQMAYIKJNUIXMQ-DNQXCXABSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

554.6
MW (Da)
3.86
ALogP
7
HBA
4
HBD
138.1
PSA (Ų)
0.24
QED
1
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H35FN2O7
MW 554.62
Aromatic Rings 3
Heavy Atoms 40
NP-Likeness -0.28

Data from ChEMBL 36 via Core Engine