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Compound Detail

CHEMBL3598301

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Oc1ccc2c3c1O[C@H]1c4[nH]c5ccccc5c4C[C@@]4(O)[C@@H](C2)N(CCF)CC[C@]314
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3598301
Phase Preclinical
Structure Type MOL
InChI Key PFHMOHCRGXRQJW-IBURTVSXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

406.5
MW (Da)
3.13
ALogP
4
HBA
3
HBD
68.7
PSA (Ų)
0.61
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H23FN2O3
MW 406.46
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness 1.27

Data from ChEMBL 36 via Core Engine