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Compound Detail

CHEMBL4651252

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Cc1ccc(CCCNCC(O)c2cc(O)cc3c2OCC(=O)N3)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4651252
Phase Preclinical
Structure Type MOL
InChI Key ICSNWNWTBVQNTP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

356.4
MW (Da)
2.29
ALogP
5
HBA
4
HBD
90.8
PSA (Ų)
0.57
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H24N2O4
MW 356.42
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.01

Data from ChEMBL 36 via Core Engine