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Compound Detail

CHEMBL4802862

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Cc1ccc(/C(=C(\CCCO)c2ccccc2)c2ccc3oc(CCN4CCNCC4)cc3c2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4802862
Phase Preclinical
Structure Type MOL
InChI Key BJQIHLQMYPDLPP-GCUVURNUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

480.6
MW (Da)
5.92
ALogP
4
HBA
2
HBD
48.6
PSA (Ų)
0.29
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H36N2O2
MW 480.65
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -0.17

Data from ChEMBL 36 via Core Engine