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Compound Detail

CHEMBL6070309

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COc1cc(CCCNCC(O)c2ccc(O)c3c2OCC(=O)N3)cc(OC)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6070309
Phase Preclinical
Structure Type MOL
InChI Key BBICGWPDSHGLCF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

432.5
MW (Da)
2.00
ALogP
8
HBA
4
HBD
118.5
PSA (Ų)
0.33
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H28N2O7
MW 432.47
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness 0.15

Data from ChEMBL 36 via Core Engine