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Compound Detail

CHEMBL5414019

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N[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5414019
Phase Preclinical
Structure Type MOL
InChI Key ZVGNGLUIAPOPDP-LLVKDONJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

261.8
MW (Da)
2.82
ALogP
3
HBA
1
HBD
42.1
PSA (Ų)
0.86
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H16ClN3
MW 261.76
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.20

Literature References

PubMed DOI Target Context # Activities
38039505 10.1021/acs.jmedchem.3c00877 Fermitin family homolog 1 1
38039505 10.1021/acs.jmedchem.3c00877 Fermitin family homolog 2 1

Data from ChEMBL 36 via Core Engine