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Compound Detail

CHEMBL241171

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Cc1ccc(C(=O)N2CCN(C(c3ccccc3)c3ccc(C)cc3)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL241171
Phase Preclinical
Structure Type MOL
InChI Key MXKOZUKLHHARJP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

384.5
MW (Da)
4.85
ALogP
2
HBA
0
HBD
23.6
PSA (Ų)
0.64
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H28N2O
MW 384.52
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.14

Literature References

PubMed DOI Target Context # Activities
17723305 10.1016/j.bmc.2007.08.013 Enoyl-[acyl-carrier-protein] reductase [NADH] 2

Data from ChEMBL 36 via Core Engine