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Compound Detail

CHEMBL1186734

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N#C[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)N1CCOCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186734
Phase Preclinical
Structure Type MOL
InChI Key YIKRVMBYHDSJKM-RYUDHWBXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

294.4
MW (Da)
-0.53
ALogP
5
HBA
1
HBD
99.7
PSA (Ų)
0.75
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 C14H22N4O3
MW 294.36
Aromatic Rings 0
Heavy Atoms 21
NP-Likeness -0.80

Data from ChEMBL 36 via Core Engine