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Compound Detail

CHEMBL252365

CLEROSTEROL
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C=C(C)[C@@H](CC)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

Basic Information

ChEMBL ID CHEMBL252365
Name CLEROSTEROL
Phase Preclinical
Structure Type MOL
InChI Key GHGKPLPBPGYSOO-FBZNIEFRSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
0
Known Names

Molecular Properties

412.7
MW (Da)
7.94
ALogP
1
HBA
1
HBD
20.2
PSA (Ų)
0.44
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C29H48O
MW 412.70
Aromatic Rings 0
Heavy Atoms 30
NP-Likeness 2.84

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0926-6690(01)00086-3 Spodoptera littoralis 2
17637068 10.1021/np070038q Trypanosoma brucei brucei 1
17637068 10.1021/np070038q J774 1
17637068 10.1021/np070038q Unchecked 1
- 10.1021/np50124a007 P388 1
- 10.1021/np50124a007 KB 1
- 10.1021/np50124a007 A549 1
- 10.1021/np50124a007 HT-29 1

Data from ChEMBL 36 via Core Engine