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Compound Detail

CHEMBL1189467

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CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)[C@@H]1CCc2c(F)ccc(-c3ccco3)c2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1189467
Phase Preclinical
Structure Type MOL
InChI Key MUFUFQQOGBVDCQ-JOCHJYFZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

494.6
MW (Da)
6.14
ALogP
4
HBA
0
HBD
53.8
PSA (Ų)
0.31
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H39FN2O3
MW 494.65
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine