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Compound Detail

CHEMBL4299845

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CCCCCCCCc1ccc(C(C[C@@H]2CCCN2)OC)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4299845
Phase Preclinical
Structure Type MOL
InChI Key SIIKEICYBVOODJ-BGERDNNASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

317.5
MW (Da)
5.42
ALogP
2
HBA
1
HBD
21.3
PSA (Ų)
0.55
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H35NO
MW 317.52
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness 0.54

Data from ChEMBL 36 via Core Engine