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Compound Detail

CHEMBL584172

NORPLUVINE
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COc1cc2c(cc1O)CN1CCC3=CC[C@@H](O)[C@@H]2[C@@H]31
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL584172
Name NORPLUVINE
Phase Preclinical
Structure Type MOL
InChI Key KYCRETLRESMMIM-DAXOMENPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
9
Publications
0
Known Names

Molecular Properties

273.3
MW (Da)
1.76
ALogP
4
HBA
2
HBD
52.9
PSA (Ų)
0.77
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C16H19NO3
MW 273.33
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 2.50

Literature References

PubMed DOI Target Context # Activities
19788245 10.1021/jm901031h NON-PROTEIN TARGET 3
20550100 10.1021/np9008255 NON-PROTEIN TARGET 3
19788245 10.1021/jm901031h A549 1
19788245 10.1021/jm901031h SK-MEL-28 1
19788245 10.1021/jm901031h B16-F10 1
20550100 10.1021/np9008255 A549 1
20550100 10.1021/np9008255 SK-MEL 1
20550100 10.1021/np9008255 B16-F10 1
31515186 10.1016/j.bmcl.2019.126642 Trypanosoma brucei rhodesiense 1

Data from ChEMBL 36 via Core Engine