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Compound Detail

CHEMBL1179619

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N#CC1C[C@@H]2C[C@@H]2N1C(=O)[C@@H](N)Cc1c[nH]c2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1179619
Phase Preclinical
Structure Type MOL
InChI Key JCRCTLVTPHWAJU-KSOLFMMOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

294.4
MW (Da)
1.55
ALogP
3
HBA
2
HBD
85.9
PSA (Ų)
0.90
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18N4O
MW 294.36
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness 0.19

Data from ChEMBL 36 via Core Engine