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Compound Detail

CHEMBL3716888

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O=C(CNCc1ccc(-c2ccccc2)cc1)NC1CCCc2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3716888
Phase Preclinical
Structure Type MOL
InChI Key RQSIMUZBXFSTPV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

370.5
MW (Da)
4.64
ALogP
2
HBA
2
HBD
41.1
PSA (Ų)
0.66
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H26N2O
MW 370.50
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.83

Data from ChEMBL 36 via Core Engine