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Compound Detail

CHEMBL144146

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CN(C(=O)N1CCC2(CCc3ccccc32)CC1)[C@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCN
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL144146
Phase Preclinical
Structure Type MOL
InChI Key XKNUACAJSZCRGE-MUUNZHRXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

515.7
MW (Da)
4.36
ALogP
3
HBA
3
HBD
94.5
PSA (Ų)
0.37
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H41N5O2
MW 515.70
Aromatic Rings 3
Heavy Atoms 38
NP-Likeness -0.23

Literature References

PubMed DOI Target Context # Activities
10091708 10.1016/s0960-894x(99)00016-5 Somatostatin receptor type 2 1

Data from ChEMBL 36 via Core Engine