Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL1852021

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CO[C@@H]1O[C@H](OC)[C@](O)(CC[C@H]2/C(=C/OS(=O)(=O)O)CC[C@H]3[C@]2(C)CC[C@H]2C(C)(C)CCC[C@]32C)[C@H]1O

Basic Information

ChEMBL ID CHEMBL1852021
Phase Preclinical
Structure Type MOL
InChI Key PHHRKQMKVGJXSM-KTHJOEBDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

546.7
MW (Da)
4.20
ALogP
8
HBA
3
HBD
131.8
PSA (Ų)
0.32
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H46O9S
MW 546.72
Aromatic Rings 0
Heavy Atoms 37
NP-Likeness 3.17

Data from ChEMBL 36 via Core Engine