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Compound Detail

CHEMBL1178593

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C[N+]1(CC2CCCCCCC2)CCC(NC(=O)C(c2ccccc2)c2ccccc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1178593
Phase Preclinical
Structure Type MOL
InChI Key BZCILPSWGDUJQI-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

433.7
MW (Da)
5.90
ALogP
1
HBA
1
HBD
29.1
PSA (Ų)
0.56
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H41N2O+
MW 433.66
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.31

Data from ChEMBL 36 via Core Engine