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Compound Detail

CHEMBL1195566

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O=C1c2ccccc2CCC12CCN(CCc1ccccc1)CC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195566
Phase Preclinical
Structure Type MOL
InChI Key RGHKOAFUHZEYJM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

319.4
MW (Da)
4.14
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.85
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H25NO
MW 319.45
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.34

Data from ChEMBL 36 via Core Engine