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Compound Detail

CHEMBL5722936

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CC(C)Oc1ccc(-c2c[nH]cc2CN(C)CC(N)=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5722936
Phase Preclinical
Structure Type MOL
InChI Key VZWALEFAWBYIMF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names

Molecular Properties

301.4
MW (Da)
2.39
ALogP
3
HBA
2
HBD
71.3
PSA (Ų)
0.82
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H23N3O2
MW 301.39
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.12

Literature References

PubMed DOI Target Context # Activities
26598975 10.1021/acschembio.5b00839 Protein arginine N-methyltransferase 1 5
26598975 10.1021/acschembio.5b00839 Protein arginine N-methyltransferase 3 1
26598975 10.1021/acschembio.5b00839 Histone-arginine methyltransferase CARM1 1
26598975 10.1021/acschembio.5b00839 Protein arginine N-methyltransferase 6 1
26598975 10.1021/acschembio.5b00839 Protein arginine N-methyltransferase 8 1
26598975 10.1021/acschembio.5b00839 Protein arginine N-methyltransferase 5 1
26598975 10.1021/acschembio.5b00839 Protein arginine N-methyltransferase 9 1
26598975 10.1021/acschembio.5b00839 Protein arginine N-methyltransferase 7 1

Data from ChEMBL 36 via Core Engine