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Compound Detail

CHEMBL5095575

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CCCCCCCc1cc(/C=C2\N=C(c3ccc(Cc4ccc(O)cc4)[nH]3)C=C2OC)[nH]c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5095575
Phase Preclinical
Structure Type MOL
InChI Key ZRIJEORGYYOMOO-VEILYXNESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

457.6
MW (Da)
6.83
ALogP
3
HBA
3
HBD
73.4
PSA (Ų)
0.28
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H35N3O2
MW 457.62
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness 0.30

Data from ChEMBL 36 via Core Engine