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Compound Detail

CHEMBL3545661

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N[C@@]1(c2ccccc2)C[C@@H]1c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3545661
Phase Preclinical
Structure Type MOL
InChI Key QIVVCMMVAICTFG-HUUCEWRRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

209.3
MW (Da)
3.03
ALogP
1
HBA
1
HBD
26.0
PSA (Ų)
0.81
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 C15H15N
MW 209.29
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness 0.53

Data from ChEMBL 36 via Core Engine