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Compound Detail

CHEMBL1187221

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N#C[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)N1CCc2ccccc2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187221
Phase Preclinical
Structure Type MOL
InChI Key CSTZZPOBGIXKER-IRXDYDNUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

340.4
MW (Da)
1.19
ALogP
4
HBA
1
HBD
90.4
PSA (Ų)
0.89
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 C19H24N4O2
MW 340.43
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness -0.73

Data from ChEMBL 36 via Core Engine