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Compound Detail

CHEMBL4646117

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Cc1cc(C)c2[nH]ccc2c1CN1CCCC[C@@H]1c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4646117
Phase Preclinical
Structure Type MOL
InChI Key GRJUTCRGMYGLQC-OAQYLSRUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

318.5
MW (Da)
5.51
ALogP
1
HBA
1
HBD
19.0
PSA (Ų)
0.67
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H26N2
MW 318.46
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.61

Literature References

PubMed DOI Target Context # Activities
32073845 10.1021/acs.jmedchem.9b01870 Complement factor B 1

Data from ChEMBL 36 via Core Engine