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Compound Detail

CHEMBL3682416

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N=C(CCl)NCCC[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)C(=O)NCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3682416
Phase Preclinical
Structure Type MOL
InChI Key OMRGEFBYEYPGEZ-DEOSSOPVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

477.0
MW (Da)
4.35
ALogP
3
HBA
4
HBD
94.1
PSA (Ų)
0.14
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H29ClN4O2
MW 477.01
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.56

Data from ChEMBL 36 via Core Engine