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Compound Detail

CHEMBL1178389

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CCC1C2Cc3ccc(O)cc3C1(CC)CCN2C(=O)C(N)Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178389
Phase Preclinical
Structure Type MOL
InChI Key KCOLUCBEDAWHHB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

392.5
MW (Da)
3.79
ALogP
3
HBA
2
HBD
66.6
PSA (Ų)
0.81
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H32N2O2
MW 392.54
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness 0.92

Data from ChEMBL 36 via Core Engine