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

CHEMBL3785468

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
CCCCNP(=O)(OC[C@H]1O[C@@H](n2cc(F)c(=O)[nH]c2=O)C[C@@H]1O)Oc1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3785468
Phase Preclinical
Structure Type MOL
InChI Key GBATUVXSBTZFHM-ZKHLZZRJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

491.8
MW (Da)
2.57
ALogP
8
HBA
3
HBD
131.9
PSA (Ų)
0.34
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H24ClFN3O7P
MW 491.84
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness 0.01

Literature References

PubMed DOI Target Context # Activities
27073055 10.1016/j.bmc.2016.04.003 HeLa 2
27073055 10.1016/j.bmc.2016.04.003 MCF7 1
27073055 10.1016/j.bmc.2016.04.003 KB 1
27073055 10.1016/j.bmc.2016.04.003 HepG2 1
27073055 10.1016/j.bmc.2016.04.003 ADMET 1

Data from ChEMBL 36 via Core Engine