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Compound Detail

CHEMBL3545667

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N[C@]1(Cc2ccc3ccccc3c2)C[C@H]1c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3545667
Phase Preclinical
Structure Type MOL
InChI Key VUMZFPRIBMBFAF-VQTJNVASSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

273.4
MW (Da)
4.27
ALogP
1
HBA
1
HBD
26.0
PSA (Ų)
0.76
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19N
MW 273.38
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness 0.47

Data from ChEMBL 36 via Core Engine