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Compound Detail

CHEMBL1194934

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CC(C)Oc1ccccc1N1CCN(Cc2cccc(CN3CCCCC3=O)n2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194934
Phase Preclinical
Structure Type MOL
InChI Key PLVXGHMFJNEQRI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

422.6
MW (Da)
3.70
ALogP
5
HBA
0
HBD
48.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H34N4O2
MW 422.57
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -1.41

Data from ChEMBL 36 via Core Engine