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Compound Detail

CHEMBL5661830

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Cc1[nH]c2ccccc2c1C1=C(c2c(C)[nH]c3ccccc23)C(=O)NC1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5661830
Phase Preclinical
Structure Type MOL
InChI Key NSVKLEKFZHEGLS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

355.4
MW (Da)
3.83
ALogP
2
HBA
3
HBD
77.8
PSA (Ų)
0.48
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H17N3O2
MW 355.40
Aromatic Rings 4
Heavy Atoms 27
NP-Likeness -0.15

Literature References

PubMed DOI Target Context # Activities
1874734 10.1016/s0021-9258(18)98476-0 Unchecked 1

Data from ChEMBL 36 via Core Engine