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Compound Detail

CHEMBL4595492

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CCCN(CCCCNC(=O)c1ccc(-c2ccccn2)cc1)CC1CC1c1ccc(Cl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595492
Phase Preclinical
Structure Type MOL
InChI Key NUFCJQQSZUHVFN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

476.1
MW (Da)
6.43
ALogP
3
HBA
1
HBD
45.2
PSA (Ų)
0.31
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H34ClN3O
MW 476.06
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -1.09

Data from ChEMBL 36 via Core Engine