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Compound Detail

CHEMBL5087508

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O=C1CCC(N2C(=O)c3cccc(N4CCN(c5ccc(NC(=O)c6cnc(Oc7ccccc7)nc6)cc5)CC4)c3C2=O)C(=O)N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5087508
Phase Preclinical
Structure Type MOL
InChI Key QPSFNFKNAUMCOB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

631.6
MW (Da)
3.25
ALogP
10
HBA
2
HBD
154.1
PSA (Ų)
0.29
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H29N7O6
MW 631.65
Aromatic Rings 4
Heavy Atoms 47
NP-Likeness -1.13

Literature References

PubMed DOI Target Context # Activities
34652145 10.1021/acs.jmedchem.1c01206 Protein cereblon/Hematopoietic prostaglandin D synthase 1
34652145 10.1021/acs.jmedchem.1c01206 Hematopoietic prostaglandin D synthase 1

Data from ChEMBL 36 via Core Engine