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Compound Detail

CHEMBL1197075

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Clc1cccc(C(OC2CC3CCC(C2)N3)c2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1197075
Phase Preclinical
Structure Type MOL
InChI Key VBIBMSGIVNIIOD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

327.9
MW (Da)
4.73
ALogP
2
HBA
1
HBD
21.3
PSA (Ų)
0.88
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 C20H22ClNO
MW 327.86
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness 0.01

Data from ChEMBL 36 via Core Engine