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Compound Detail

CHEMBL1199899

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CC(C)Oc1ccccc1N1CCN(Cc2ccc(CN(C(=O)C3CCCCC3)C(C)C)n2C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1199899
Phase Preclinical
Structure Type MOL
InChI Key ZBHZVMMPAAMZQJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

494.7
MW (Da)
5.45
ALogP
5
HBA
0
HBD
41.0
PSA (Ų)
0.46
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H46N4O2
MW 494.72
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness -1.31

Data from ChEMBL 36 via Core Engine