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Compound Detail

CHEMBL5401685

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C1=C(c2n[nH]c3ccc(-c4ccccc4)cc23)CNCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5401685
Phase Preclinical
Structure Type MOL
InChI Key SIZZPQGUJJXTFS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

275.4
MW (Da)
3.61
ALogP
2
HBA
2
HBD
40.7
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H17N3
MW 275.36
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -0.28

Literature References

PubMed DOI Target Context # Activities
38352850 10.1021/acsmedchemlett.3c00566 5-hydroxytryptamine receptor 2B 3
38352850 10.1021/acsmedchemlett.3c00566 5-hydroxytryptamine receptor 2C 3
38352850 10.1021/acsmedchemlett.3c00566 5-hydroxytryptamine receptor 2A 2

Data from ChEMBL 36 via Core Engine