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Compound Detail

CHEMBL1191385

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

Basic Information

ChEMBL ID CHEMBL1191385
Phase Preclinical
Structure Type MOL
InChI Key CXIQQOIATMENRH-OAQYLSRUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

470.6
MW (Da)
5.09
ALogP
4
HBA
0
HBD
57.7
PSA (Ų)
0.29
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 C28H39FN2O3
MW 470.63
Aromatic Rings 1
Heavy Atoms 34
NP-Likeness -0.74

Data from ChEMBL 36 via Core Engine