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Compound Detail

CHEMBL375234

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CC1(C)CC[C@]23CC[C@]4(C)[C@H](CC[C@@H]5[C@@]6(C)Cc7nc8ccccc8nc7C(C)(C)[C@@H]6CC[C@]54C)[C@H]2[C@H]1O3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL375234
Phase Preclinical
Structure Type MOL
InChI Key GHQDCKYBUJNIAT-WUKNXDJTSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

512.8
MW (Da)
8.29
ALogP
3
HBA
0
HBD
35.0
PSA (Ų)
0.36
QED
2
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H48N2O
MW 512.78
Aromatic Rings 2
Heavy Atoms 38
NP-Likeness 2.32

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
17371067 10.1021/np060436d CCRF-CEM 1

Data from ChEMBL 36 via Core Engine