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Compound Detail

CHEMBL4117606

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N#Cc1cccc([C@H]2CCN[C@@H]2C(=O)O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4117606
Phase Preclinical
Structure Type MOL
InChI Key GKHDOGUJAPNIHQ-MNOVXSKESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

216.2
MW (Da)
1.09
ALogP
3
HBA
2
HBD
73.1
PSA (Ų)
0.78
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H12N2O2
MW 216.24
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -0.16

Data from ChEMBL 36 via Core Engine