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Compound Detail

CHEMBL5077912

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CC(=O)O[C@@]1(C(C)=O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3[C@@H](C)C[C@@]21C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5077912
Phase Preclinical
Structure Type MOL
InChI Key IWSXBCZCPVUWHT-GFNZRIEASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

372.5
MW (Da)
4.27
ALogP
4
HBA
0
HBD
60.4
PSA (Ų)
0.68
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C23H32O4
MW 372.51
Aromatic Rings 0
Heavy Atoms 27
NP-Likeness 2.13

Literature References

PubMed DOI Target Context # Activities
34607200 10.1016/j.bmc.2021.116425 Progesterone receptor 3

Data from ChEMBL 36 via Core Engine