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Compound Detail

CHEMBL233761

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Cc1cc(C)cc(-c2[nH]c3c(c2[C@H](C)CNCCc2ccncc2)CNCC3)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL233761
Phase Preclinical
Structure Type MOL
InChI Key CGMXRZJAQKSMCY-LJQANCHMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

388.6
MW (Da)
4.28
ALogP
3
HBA
3
HBD
52.7
PSA (Ų)
0.53
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H32N4
MW 388.56
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.45

Literature References

PubMed DOI Target Context # Activities
17521908 10.1016/j.bmcl.2007.05.009 Gonadotropin-releasing hormone receptor 3

Data from ChEMBL 36 via Core Engine