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Compound Detail

CHEMBL1187344

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Cc1ccc(/C=C2\CN(C(=O)c3ccc(OCCN4CCCCC4)cc3)C/C(=C\c3ccc(C)cc3)C2=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187344
Phase Preclinical
Structure Type MOL
InChI Key CIWTXPINUHSAFH-FEBMMXQDSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

534.7
MW (Da)
6.36
ALogP
4
HBA
0
HBD
49.9
PSA (Ų)
0.33
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H38N2O3
MW 534.70
Aromatic Rings 3
Heavy Atoms 40
NP-Likeness -0.82

Data from ChEMBL 36 via Core Engine