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Compound Detail

CHEMBL1183944

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COc1ccc(NC(=O)N2CCN(c3ccccc3)CC2)cc1N1CCN(C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1183944
Phase Preclinical
Structure Type MOL
InChI Key YROAYJXTFUCFFK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

409.5
MW (Da)
2.80
ALogP
5
HBA
1
HBD
51.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H31N5O2
MW 409.53
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -1.66

Data from ChEMBL 36 via Core Engine