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Compound Detail

CHEMBL1198853

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N[C@@H](CCC(=O)N1CCN(CC2CCOCC2)CC1)Cc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1198853
Phase Preclinical
Structure Type MOL
InChI Key VOLFGWIQFJNTOT-FQEVSTJZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

359.5
MW (Da)
1.91
ALogP
4
HBA
1
HBD
58.8
PSA (Ų)
0.81
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H33N3O2
MW 359.51
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -0.82

Data from ChEMBL 36 via Core Engine