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Compound Detail

CHEMBL1186679

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COC[C@H]1CCCN1C(=O)CC[C@H](N)C(=O)N1CCC[C@H]1C#N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186679
Phase Preclinical
Structure Type MOL
InChI Key HNNVETJNGHJPTM-MJBXVCDLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

322.4
MW (Da)
0.25
ALogP
5
HBA
1
HBD
99.7
PSA (Ų)
0.76
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H26N4O3
MW 322.41
Aromatic Rings 0
Heavy Atoms 23
NP-Likeness -0.27

Data from ChEMBL 36 via Core Engine