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Compound Detail

CHEMBL107557

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CCCN1Cc2cccc3[nH]c(Cl)c(c23)CC1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL107557
Phase Preclinical
Structure Type MOL
InChI Key UFFKBSBMSIUDNM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

262.8
MW (Da)
3.98
ALogP
1
HBA
1
HBD
19.0
PSA (Ų)
0.87
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H19ClN2
MW 262.78
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.02

Literature References

PubMed DOI Target Context # Activities
1956037 10.1021/jm00115a007 MT4 1

Data from ChEMBL 36 via Core Engine