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Compound Detail

CHEMBL2079462

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COCCCOc1ccccc1N1CCN(CC(N)C(O)CC(C(=O)NCC(C)(C)C(N)=O)C(C)C)CC1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2079462
Phase Preclinical
Structure Type MOL
InChI Key FOAHAYKWNMPVJI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

549.7
MW (Da)
0.73
ALogP
8
HBA
4
HBD
160.4
PSA (Ų)
0.22
QED
1
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H47N5O6
MW 549.71
Aromatic Rings 1
Heavy Atoms 39
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine