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Compound Detail

CHEMBL1197793

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CCCC(c1nnnn1C1CCCCC1)N1CCN(C(=O)c2ccco2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1197793
Phase Preclinical
Structure Type MOL
InChI Key CMDUPELKYFELQB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

386.5
MW (Da)
3.07
ALogP
7
HBA
0
HBD
80.3
PSA (Ų)
0.76
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H30N6O2
MW 386.50
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -2.04

Data from ChEMBL 36 via Core Engine