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Compound Detail

CHEMBL485570

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CCCCCOc1ccc2c(c1)Cc1ccccc1C2CN
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL485570
Phase Preclinical
Structure Type MOL
InChI Key KHRULRPXLWORPF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

295.4
MW (Da)
4.25
ALogP
2
HBA
1
HBD
35.2
PSA (Ų)
0.81
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 C20H25NO
MW 295.43
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -0.03

Data from ChEMBL 36 via Core Engine