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Compound Detail

CHEMBL1187354

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NCC1CC1c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187354
Phase Preclinical
Structure Type MOL
InChI Key ATTLDOZXPZCOGK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

147.2
MW (Da)
1.75
ALogP
1
HBA
1
HBD
26.0
PSA (Ų)
0.68
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 C10H13N
MW 147.22
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness 0.46

Data from ChEMBL 36 via Core Engine