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Compound Detail

CHEMBL5971366

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CCO[C@@H](Cc1ccc(OCc2cc(CO)ccn2)cc1)C(=O)NO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5971366
Phase Preclinical
Structure Type MOL
InChI Key AXSMDNDSPLOIEQ-KRWDZBQOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

346.4
MW (Da)
1.61
ALogP
6
HBA
3
HBD
100.9
PSA (Ų)
0.47
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H22N2O5
MW 346.38
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.28

Data from ChEMBL 36 via Core Engine