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Compound Detail

CHEMBL6069369

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CC[N+]1(CC)CCN(c2ccc(-c3ncco3)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6069369
Phase Preclinical
Structure Type MOL
InChI Key CMBMRPOWZJVUIK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

286.4
MW (Da)
3.02
ALogP
3
HBA
0
HBD
29.3
PSA (Ų)
0.81
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H24N3O+
MW 286.40
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.68

Data from ChEMBL 36 via Core Engine