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Compound Detail

CHEMBL28982

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COc1ccc(O)c(C(=O)c2ccc(CO[C@@H]3CCCNCC3NC(=O)c3ccncc3)cc2)c1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL28982
Phase Preclinical
Structure Type MOL
InChI Key PDMPNESLWSOZQA-LWMIZPGFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

493.5
MW (Da)
3.23
ALogP
7
HBA
3
HBD
109.8
PSA (Ų)
0.41
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H28FN3O5
MW 493.54
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -0.15

Data from ChEMBL 36 via Core Engine