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Compound Detail

CHEMBL5779068

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CN(C)C/C=C/C(=O)N[C@@H]1CCc2c(-c3ccc(Oc4ccccc4)cc3)c3c(N)ncnc3n2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5779068
Phase Preclinical
Structure Type MOL
InChI Key PZWFSBGEZWBPCO-AQDCRGGLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

482.6
MW (Da)
4.02
ALogP
7
HBA
2
HBD
98.3
PSA (Ų)
0.39
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H30N6O2
MW 482.59
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -0.58

Data from ChEMBL 36 via Core Engine