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Compound Detail

CHEMBL6069257

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COC1=CC(c2ccc(Cc3ccc(OC)cc3)[nH]2)=N/C1=C\NC12CC3CC(CC(C3)C1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6069257
Phase Preclinical
Structure Type MOL
InChI Key GNXDAYXSYNCUSY-ONUIUJJFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

443.6
MW (Da)
5.35
ALogP
4
HBA
2
HBD
58.6
PSA (Ų)
0.61
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H33N3O2
MW 443.59
Aromatic Rings 2
Heavy Atoms 33
NP-Likeness -0.02

Data from ChEMBL 36 via Core Engine