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Compound Detail

CHEMBL3967458

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COC(=O)CCCCCC[C@@H]1[C@@H](c2ccc(CC3CCCCC3)cc2)[C@H](O)C[C@H]1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3967458
Phase Preclinical
Structure Type MOL
InChI Key BELBFBSHUITIAA-POMLREGLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

435.1
MW (Da)
6.39
ALogP
3
HBA
1
HBD
46.5
PSA (Ų)
0.26
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H39ClO3
MW 435.05
Aromatic Rings 1
Heavy Atoms 30
NP-Likeness 0.81

Data from ChEMBL 36 via Core Engine