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Compound Detail

CHEMBL3545673

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

Basic Information

ChEMBL ID CHEMBL3545673
Phase Preclinical
Structure Type MOL
InChI Key KCILWLSZXAAOSR-NWDGAFQWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

175.3
MW (Da)
2.67
ALogP
1
HBA
1
HBD
26.0
PSA (Ų)
0.75
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 C12H17N
MW 175.27
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness 0.89

Data from ChEMBL 36 via Core Engine